4-Chloro-3-nitrobenzoic acid

Modify Date: 2025-08-20 12:43:29

4-Chloro-3-nitrobenzoic acid structure	Common Name	4-Chloro-3-nitrobenzoic acid
	CAS Number	96-99-1	Molecular Weight	201.564
	Density	1.6±0.1 g/cm3	Boiling Point	371.6±27.0 °C at 760 mmHg
	Molecular Formula	C₇H₄ClNO₄	Melting Point	180-183 °C(lit.)
	MSDS	Chinese USA	Flash Point	178.5±23.7 °C
	Symbol	GHS07	Signal Word	Warning

Name	4-Chloro-3-nitrobenzoic Acid
Synonym	More Synonyms

Density	1.6±0.1 g/cm3
Boiling Point	371.6±27.0 °C at 760 mmHg
Melting Point	180-183 °C(lit.)
Molecular Formula	C₇H₄ClNO₄
Molecular Weight	201.564
Flash Point	178.5±23.7 °C
Exact Mass	200.982880
PSA	83.12000
LogP	2.37
Vapour Pressure	0.0±0.9 mmHg at 25°C
Index of Refraction	1.628
InChIKey	DFXQXFGFOLXAPO-UHFFFAOYSA-N
SMILES	O=C(O)c1ccc(Cl)c([N+](=O)[O-])c1

4-Chloro-3-nitrobenzoic acid MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DG5425050

CHEMICAL NAME :: Benzoic acid, 4-chloro-3-nitro-

CAS REGISTRY NUMBER :: 96-99-1

BEILSTEIN REFERENCE NO. :: 0783626

LAST UPDATED :: 199710

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C7-H4-Cl-N-O4

MOLECULAR WEIGHT :: 201.57

WISWESSER LINE NOTATION :: WNR BG EVQ

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 :: 3150 mg/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 :: Oral

SPECIES OBSERVED :: Bird - wild bird species

DOSE/DURATION :: 75 mg/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 :: 500 ug/plate

REFERENCE :: SAIGBL Sangyo Igaku. Japanese Journal of Industrial Health. (Nippon Sangyo Eisei Igakkai, Kosu Eisei Bldg., 1-29-8, Shinjuku, Shinjuku-ku, Tokyo 160, Japan) V.1- 1959- Volume(issue)/page/year: 29,34,1987

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xi:Irritant
Risk Phrases	R36/37/38
Safety Phrases	S26-S24/25
RIDADR	NONH for all modes of transport
WGK Germany	2
RTECS	DG5425050
HS Code	2918990090

Precursor 10
CAS#:74-11-3 4-Chlorobenzoic acid CAS#:38818-50-7 4-Chloro-3-nitr... CAS#:84314-04-5 4-(4-chloro-3-n... CAS#:939-80-0 4-Chloro-3-nitr...
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DownStream 10
CAS#:429659-01-8 Ethyl 3-(4-(met... CAS#:38818-50-7 4-Chloro-3-nitr... CAS#:62754-14-7 cyclohexyl 4-ch... CAS#:55302-98-2 5-Amino-4-chlor...
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CAS#:51207-31-9 2,3,7,8-Tetrach... CAS#:1746-01-6 2,3,7,8-Tetrach...

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%

Elastic and bendable caffeine cocrystals: implications for the design of flexible organic materials.

Angew. Chem. Int. Ed. Engl. 51(41) , 10319-23, (2012)

[Evaluation of the hepatotoxic activity of several chlor-nitro derivatives of benzoic acid].

Vopr. Med. Khim. 29(6) , 113-7, (1983)

Hepatotoxic effects of 4-chloro-3-nitrobenzoic acid (x-NBA), 3-nitrobenzoic acid (NBA) and 4-chlorobenzoic acid (CBA) were studied at the doses corresponding to LD50, 1/10 LD50 and 1/50 LD50. The toxi...

Preparation and antibacterial activity of copper and cobalt complexes of 4-chloro-3-nitrobenzoate with a nitrogen donor ligand.

Chem. Pharm. Bull. 55(3) , 446-50, (2007)

Copper and cobalt complexes with 4-chloro-3-nitrobenzoate (ClNBz) and the nitrogen ligands 1,3-diaminopropane (1,3-DAP) or o-phenylenediamine (o-PDA), were prepared and characterized. The complexes [C...

Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose

Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose

Name: Toxicity in po dosed Rattus norvegicus (rat)
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL3059484

Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT

Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN

Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN

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4-Chloro-3-nitrobenzoic acid

MFCD00007079

EINECS 202-550-9

3-Nitro-4-chlorobenzoic acid

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China
Product Name: 4-Chloro-3-nitrobenzoic acid
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Dayang Chem (Hangzhou) Co., Ltd.
China
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Shanghai Jizhi Biochemical Technology Co., Ltd
China
Product Name: 4-Chloro-3-nitrobenzoic acid
Price: ￥278.0/500g ￥88.0/100g
Purity: 99.0%
Delivery: Inquiry
Contact: Liu jia
Email: 2130147988@qq.com

Henan Tianfu Chemical Co., Ltd.
China
Product Name: 4-Chloro-3-nitrobenzoic Acid
Price: $Inquiry/1kg $Inquiry/25kg $Inquiry/1000kg $Inquiry/10ton
Purity: 99.0%
Delivery: Inquiry
Contact: Anson
Email: info@tianfuchem.com

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4-Chloro-3-nitrobenzoic acid

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MSDS

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CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

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