5-Nitro-1,2-dihydroacenaphthylene

Modify Date: 2026-07-15 19:27:40

5-Nitro-1,2-dihydroacenaphthylene structure	Common Name	5-Nitro-1,2-dihydroacenaphthylene
	CAS Number	602-87-9	Molecular Weight	199.205
	Density	1.4±0.1 g/cm3	Boiling Point	377.5±21.0 °C at 760 mmHg
	Molecular Formula	C₁₂H₉NO₂	Melting Point	100-101 °C(lit.)
	MSDS	Chinese USA	Flash Point	191.8±14.9 °C
	Symbol	GHS08	Signal Word	Danger

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name	5-Nitroacenaphthene
Synonym	More Synonyms

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density	1.4±0.1 g/cm3
Boiling Point	377.5±21.0 °C at 760 mmHg
Melting Point	100-101 °C(lit.)
Molecular Formula	C₁₂H₉NO₂
Molecular Weight	199.205
Flash Point	191.8±14.9 °C
Exact Mass	199.063324
PSA	45.82000
LogP	3.92
Vapour Pressure	0.0±0.8 mmHg at 25°C
Index of Refraction	1.724
InChIKey	CUARLQDWYSRQDF-UHFFFAOYSA-N
SMILES	O=[N+]([O-])c1ccc2c3c(cccc13)CC2
Stability	Stable. Combustible. Incompatible with strong oxidizing agents.

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

5-Nitro-1,2-dihydroacenaphthylene MSDS(Chinese)

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AB1060000

CHEMICAL NAME :: Acenaphthene, 5-nitro-

CAS REGISTRY NUMBER :: 602-87-9

BEILSTEIN REFERENCE NO. :: 1876864

LAST UPDATED :: 199701

DATA ITEMS CITED :: 23

MOLECULAR FORMULA :: C12-H9-N-O2

MOLECULAR WEIGHT :: 199.22

WISWESSER LINE NOTATION :: L566 1A LT&&J HNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 40 gm/kg/78W-C

TOXIC EFFECTS :: Tumorigenic - Carcinogenic by RTECS criteria Sense Organs and Special Senses (Ear) - effect, not otherwise specified Lungs, Thorax, or Respiration - tumors

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 33 gm/kg/78W-C

TOXIC EFFECTS :: Tumorigenic - Carcinogenic by RTECS criteria Liver - tumors Reproductive - Tumorigenic effects - ovarian tumors

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 3744 mg/kg/78W-I

TOXIC EFFECTS :: Tumorigenic - equivocal tumorigenic agent by RTECS criteria Blood - leukemia Blood - lymphoma, including Hodgkin's disease

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Implant

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 160 mg/kg

TOXIC EFFECTS :: Tumorigenic - equivocal tumorigenic agent by RTECS criteria Kidney, Ureter, Bladder - tumors

TYPE OF TEST :: TD - Toxic dose (other than lowest)

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 120 gm/kg/17W-C

TOXIC EFFECTS :: Tumorigenic - Carcinogenic by RTECS criteria Gastrointestinal - tumors Skin and Appendages - tumors

TYPE OF TEST :: TD - Toxic dose (other than lowest)

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 60 gm/kg/70W-C

TOXIC EFFECTS :: Tumorigenic - Carcinogenic by RTECS criteria Sense Organs and Special Senses (Ear) - effect, not otherwise specified Lungs, Thorax, or Respiration - tumors

TYPE OF TEST :: TD - Toxic dose (other than lowest)

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 80 gm/kg/78W-C

TOXIC EFFECTS :: Tumorigenic - Carcinogenic by RTECS criteria Lungs, Thorax, or Respiration - tumors Reproductive - Tumorigenic effects - ovarian tumors

TYPE OF TEST :: TD - Toxic dose (other than lowest)

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 61 gm/kg/17W-C

TOXIC EFFECTS :: Tumorigenic - Carcinogenic by RTECS criteria Gastrointestinal - tumors

MUTATION DATA

TYPE OF TEST :: Unscheduled DNA synthesis

TEST SYSTEM :: Rodent - mouse Liver

DOSE/DURATION :: 200 mg/L

REFERENCE :: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 190,159,1987 *** REVIEWS *** IARC Cancer Review:Animal Sufficient Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 16,319,1978 IARC Cancer Review:Human No Adequate Data IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 16,319,1978 IARC Cancer Review:Group 2B IMSUDL IARC Monographs, Supplement. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) No.1- 1979- Volume(issue)/page/year: 7,56,1987 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-FINLAND;Carcinogen JAN 1993 OEL-FRANCE;Carcinogen JAN 1993 OEL-GERMANY;Carcinogen JAN 1993 OEL-SWITZERLAND;Carcinogen JAN 1993

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Symbol	GHS08
Signal Word	Danger
Hazard Statements	H350
Precautionary Statements	P201-P308 + P313
Personal Protective Equipment	Eyeshields;Gloves;type P2 (EN 143) respirator cartridges
Hazard Codes	T,Xi
Risk Phrases	R45
Safety Phrases	S53-S45
RIDADR	2811
WGK Germany	3
RTECS	AB1060000
HS Code	2904209090

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

Acenaphthene

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Literature: Khosravi; Moradian; Gharanjig; Afshar Taromi Journal of the Chinese Chemical Society, 2005 , vol. 52, # 3 p. 495 - 502

Acenaphthene

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Acenaphthylene,...

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Literature: Russian Chemical Bulletin, , vol. 43, # 3 p. 507 - 508 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, , # 3 p. 547 - 548

(6-Amino-1,2-di...

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Literature: Journal of Organic Chemistry USSR (English Translation), , vol. 13, p. 568 - 571 Zhurnal Organicheskoi Khimii, , vol. 13, # 3 p. 620 - 624

Diethyl ether

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Acenaphthene

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Literature: Gazzetta Chimica Italiana, , vol. 66, p. 31,36, 126

Acenaphthene

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acetic acid

CAS#:64-19-7

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Literature: Gazzetta Chimica Italiana, , vol. 66, p. 31,36, 126

Acenaphthene

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benzene

CAS#:71-43-2

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Literature: Gazzetta Chimica Italiana, , vol. 66, p. 31,36, 126

nitric acid

CAS#:7697-37-2

Ethanoic anhydride

CAS#:108-24-7

Acenaphthene

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Acenaphthylene,...

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Literature: Journal of the Society of Chemical Industry, London, , vol. 49, p. 413 T, 421 T Journal of Organic Chemistry, , vol. 24, p. 214,218

nitric acid

CAS#:7697-37-2

Acenaphthene

CAS#:83-32-9

acetic acid

CAS#:64-19-7

5-Nitro-1,2-dih...

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Literature: Bulletin de la Societe Chimique de France, , vol. <2> 48, p. 755 Chemische Berichte, , vol. 20, p. 610 Chemische Berichte, , vol. 21, p. 1455

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code	2904209090
Summary	2904209090 derivatives containing only nitro or only nitroso groups。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

This table lists relevant public references with title, journal and publication metadata for this compound.

5-Nitroacenaphthene: a newly recognized role for the nitro function in mutagenicity.

Environ. Mutagen. 5(1) , 17-22, (1983)

The direct-acting mutagenicity of 5-nitroacenaphthene for Salmonella typhimurium is dependent upon the reduction of the nitro function as evidenced by the significant decrease in mutagenicity seen wit...

Identification of mutagenic metabolites formed by C-hydroxylation and nitroreduction of 5-nitroacenaphthene in rat liver.

Cancer Res. 42(4) , 1243-8, (1982)

The metabolism of the mutagen and carcinogen, 5-nitroacenaphthene, by the 9000 x g supernatant from the livers of Aroclor-pretreated rats was studied. The major primary metabolites were 1-hydroxy-5-ni...

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Cytochrome P450 Family 1 Subfamily A Member 2 (CYP1A2) small molecule antagonists: lu...
Source: 824
External Id: CYP273

Name: p53 small molecule agonists, cell-based qHTS assay: qHTS cell viability counter scree...
Source: 824
Target: N/A
External Id: P53600

Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: qHTS ce...
Source: 824
Target: N/A
External Id: P53MS958

Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: Summary
Source: 824
External Id: P53MS482

Name: p53 small molecule agonists, cell-based qHTS assay
Source: 824
External Id: P53344

Name: p53 small molecule agonists, cell-based qHTS assay with human liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS233

Name: p53 small molecule agonists, cell-based qHTS assay with human liver microsomes: qHTS ...
Source: 824
Target: N/A
External Id: P53MS837

Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS898

Name: qHTS Assay for Small Molecule Inhibitors of the Human hERG Channel Activity
Source: NCGC
External Id: HERG01

Name: Adrenergic beta2 receptor (ADRB2) small molecule agonists, cell-based qHTS assay
Source: 824
External Id: ADRB2293

Total 214, Current Page 1 of 22

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

EINECS 210-025-0

5-Nitro-1,2-dihydroacenaphthylene

MFCD00014277

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the polar surface area (PSA) of 5-Nitroacenaphthene?

A: Polar surface area (PSA) of 5-Nitroacenaphthene is 45.82000.

Q: What is the CAS number of 5-Nitroacenaphthene?

A: CAS number of 5-Nitroacenaphthene is 602-87-9.

Q: What is the melting point of 5-Nitroacenaphthene?

A: Melting point of 5-Nitroacenaphthene is 100-101 °C(lit.).

Q: What is the SMILES notation of 5-Nitroacenaphthene?

A: SMILES notation of 5-Nitroacenaphthene is O=[N+]([O-])c1ccc2c3c(cccc13)CC2.

Q: What is the molecular formula of 5-Nitroacenaphthene?

A: Molecular formula of 5-Nitroacenaphthene is C12H9NO2.

Q: What is the safety information for 5-Nitroacenaphthene?

A: Safety information for 5-Nitroacenaphthene: S53-S45.

Q: What is the boiling point of 5-Nitroacenaphthene?

A: Boiling point of 5-Nitroacenaphthene is 377.5±21.0 °C at 760 mmHg.

Q: What is the InChIKey of 5-Nitroacenaphthene?

A: InChIKey of 5-Nitroacenaphthene is CUARLQDWYSRQDF-UHFFFAOYSA-N.

Q: What English synonyms does 5-Nitroacenaphthene have?

A: English synonyms of 5-Nitroacenaphthene: EINECS 210-025-0, 5-Nitro-1,2-dihydroacenaphthylene, MFCD00014277.

Q: What is the molecular weight of 5-Nitroacenaphthene?

A: Molecular weight of 5-Nitroacenaphthene is 199.205.

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd

Dayang Chem (Hangzhou) Co., Ltd.

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.

Shanghai Nianxing Industrial Co., Ltd
China
Product Name: 5-Nitro-1,2-dihydroacenaphthylene
Price: Check
Purity: 85.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 5-Nitroacenaphthene
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

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5-Nitro-1,2-dihydroacenaphthylene

Names

Chemical & Physical Properties

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

Safety Information

Synthetic Route

Customs

Articles2

5-Nitro-1,2-dihydroacenaphthyleneBioassay

Synonyms

5-Nitro-1,2-dihydroacenaphthylene | FAQ

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The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.