1H-Benz[de]isoquinoline-1,3(2H)-dione,5-nitro-2-[2-(1-pyrrolidinyl)ethyl]-

Modify Date: 2025-08-25 19:03:08

1H-Benz[de]isoquinoline-1,3(2H)-dione,5-nitro-2-[2-(1-pyrrolidinyl)ethyl]- structure	Common Name	1H-Benz[de]isoquinoline-1,3(2H)-dione,5-nitro-2-[2-(1-pyrrolidinyl)ethyl]-
	CAS Number	54824-20-3	Molecular Weight	339.34500
	Density	1.402g/cm3	Boiling Point	548ºC at 760 mmHg
	Molecular Formula	C₁₈H₁₇N₃O₄	Melting Point	N/A
	MSDS	N/A	Flash Point	285.2ºC

Name	5-nitro-2-(2-pyrrolidin-1-ylethyl)benzo[de]isoquinoline-1,3-dione
Synonym	More Synonyms

Density	1.402g/cm3
Boiling Point	548ºC at 760 mmHg
Molecular Formula	C₁₈H₁₇N₃O₄
Molecular Weight	339.34500
Flash Point	285.2ºC
Exact Mass	339.12200
PSA	88.13000
LogP	2.41780
Index of Refraction	1.679
InChIKey	GBOQUHPYCRYKGV-UHFFFAOYSA-N
SMILES	O=C1c2cccc3cc([N+](=O)[O-])cc(c23)C(=O)N1CCN1CCCC1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QK5980000

CHEMICAL NAME :: Naphthalimide, 2-(2-(pyrrolidinyl)ethyl)-5-nitro-

CAS REGISTRY NUMBER :: 54824-20-3

LAST UPDATED :: 199612

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C18-H17-N3-O4

MOLECULAR WEIGHT :: 339.38

WISWESSER LINE NOTATION :: T666 1A M CVNVJ D2- AT5NTJ& HNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 4500 ug/kg

TOXIC EFFECTS :: Tumorigenic - active as anti-cancer agent

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 12600 ug/kg

TOXIC EFFECTS :: Tumorigenic - active as anti-cancer agent

MUTATION DATA

TYPE OF TEST :: Mutation test systems - not otherwise specified

TEST SYSTEM :: Rodent - mouse Ascites tumor

DOSE/DURATION :: 3 mg/L

REFERENCE :: CCPHDZ Cancer Chemotherapy and Pharmacology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1978- Volume(issue)/page/year: 4,61,1980

HS Code	2933990090

1-(2-Aminoethyl...

CAS#:7154-73-6

5-Nitro-1H,3H-b...

CAS#:3027-38-1

1H-Benz[de]isoq...

CAS#:54824-20-3

Literature: Zee-Cheng; Cheng Journal of Medicinal Chemistry, 1985 , vol. 28, # 9 p. 1216 - 1222

Precursor 2
CAS#:7154-73-6 1-(2-Aminoethyl... CAS#:3027-38-1 5-Nitro-1H,3H-b...
DownStream 0

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1H-Benz[de]isoquinoline-1,5-nitro-2-[2-(1-pyrrolidinyl)ethyl]

Pinafide

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1H-Benz[de]isoquinoline-1,3(2H)-dione,5-nitro-2-[2-(1-pyrrolidinyl)ethyl]-

Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

Safety Information

Synthetic Route

Precursor & DownStream

Customs

Synonyms

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.