3-Nitrobenzoyl chloride

Modify Date: 2026-07-04 14:55:03

3-Nitrobenzoyl chloride structure	Common Name	3-Nitrobenzoyl chloride
	CAS Number	121-90-4	Molecular Weight	185.565
	Density	1.5±0.1 g/cm3	Boiling Point	277.3±13.0 °C at 760 mmHg
	Molecular Formula	C₇H₄ClNO₃	Melting Point	31-34 °C(lit.)
	MSDS	Chinese USA	Flash Point	121.5±19.8 °C
	Symbol	GHS05, GHS06	Signal Word	Danger

Name	3-Nitrobenzoyl Chloride
Synonym	More Synonyms

Density	1.5±0.1 g/cm3
Boiling Point	277.3±13.0 °C at 760 mmHg
Melting Point	31-34 °C(lit.)
Molecular Formula	C₇H₄ClNO₃
Molecular Weight	185.565
Flash Point	121.5±19.8 °C
Exact Mass	184.987976
PSA	62.89000
LogP	2.12
Vapour Pressure	0.0±0.6 mmHg at 25°C
Index of Refraction	1.589
InChIKey	NXTNASSYJUXJDV-UHFFFAOYSA-N
SMILES	O=C(Cl)c1cccc([N+](=O)[O-])c1
Water Solubility	decomposes

3-Nitrobenzoyl chloride MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DM6646000

CHEMICAL NAME :: Benzoyl chloride, m-nitro-

CAS REGISTRY NUMBER :: 121-90-4

BEILSTEIN REFERENCE NO. :: 0777186

LAST UPDATED :: 199710

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C7-H4-Cl-N-O3

MOLECULAR WEIGHT :: 185.57

WISWESSER LINE NOTATION :: WNR CVG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 2460 uL/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

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

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 790 uL/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Bacteria - Salmonella typhimurium

DOSE/DURATION :: 100 ug/plate

REFERENCE :: ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 9(Suppl 9),1,1987

Symbol	GHS05, GHS06
Signal Word	Danger
Hazard Statements	H311-H314
Supplemental HS	Risk of explosion if heated under confinement.
Precautionary Statements	P280-P305 + P351 + P338-P310
Personal Protective Equipment	Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges
Hazard Codes	C:Corrosive;
Risk Phrases	R21;R34
Safety Phrases	S26-S36/37/39-S45-S7/9-S38
RIDADR	UN 2923 8/PG 3
WGK Germany	3
RTECS	DM6646000
Packaging Group	II
Hazard Class	8
HS Code	29163900

Precursor 9
CAS#:121-92-6 3-Nitrobenzoic acid CAS#:79-37-8 Oxalyl chloride CAS#:618-94-0 3-Nitrobenzhydrazide CAS#:99-61-6 3-Nitrobenzaldehyde
CAS#:93-58-3 Methyl benzoate CAS#:618-95-1 Methyl 3-nitrob... CAS#:98-88-4 Benzoyl chloride CAS#:69859-37-6 m-nitrobenzoic ...
CAS#:56-23-5 Carbon tetrachloride
DownStream 10
CAS#:109899-85-6 1-(2-hydroxyphe... CAS#:109899-88-9 (2-acetylphenyl... CAS#:106274-98-0 S-(3-nitrobenzo... CAS#:3320-87-4 3-nitrophenyl i...
CAS#:3400-26-8 Benzamide,N-met... CAS#:313502-13-5 2-(3-aminopheny... CAS#:341529-34-8 (3N-[(2S,3S)-2-... CAS#:101-24-6 Benzamide,3-nit...
CAS#:33240-96-9 3-NITROANILINE ... CAS#:149505-87-3 3'-NITRO-[1,1'-...

HS Code	2916399090
Summary	2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Synthesis and cytotoxic effect of carbocyclic potential minor groove binders.

Il Farmaco 59(3) , 211-4, (2004)

New carbocyclic potential minor groove binders were synthesised, using 3-nitrobenzoyl chloride and aliphatic alpha,omega-diamines with three, four and five methylene fragments. The half structures, co...

The effect of inhibition of (ADP-ribose)n biosynthesis on DNA repair assayed by the nucleoid technique.

Eur. J. Biochem. 121(1) , 65-9, (1981)

DNA damage and repair was assayed by the loss and restoration of DNA supercoiling in nucleoids. This technique was used to assess the effects of inhibition of (ADP-ribose)n biosynthesis by 3-aminobenz...

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

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3-Nitrobenzoyl chloride

MFCD00007247

EINECS 204-505-9

m-Nitrobenzoyl chloride

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China
Product Name: 3-Nitrobenzoyl chloride
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China
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Henan Tianfu Chemical Co., Ltd.
China
Product Name: m-Nitrobenzoyl chloride 121-90-4 best quality
Price: $Inquiry/1kg $Inquiry/25kg $Inquiry/1000kg $Inquiry/10ton
Purity: 99.0%
Delivery: Inquiry
Contact: Anson
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3-Nitrobenzoyl chloride

Names

Chemical & Physical Properties

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

Safety Information

Synthetic Route

Precursor & DownStream

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Articles2

3-Nitrobenzoyl chlorideBioassay

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.