2-(4-Chloro-3-nitrobenzoyl)benzoic acid

Modify Date: 2026-07-04 11:44:10

2-(4-Chloro-3-nitrobenzoyl)benzoic acid Structure
2-(4-Chloro-3-nitrobenzoyl)benzoic acid structure
Common Name 2-(4-Chloro-3-nitrobenzoyl)benzoic acid
CAS Number 85-54-1 Molecular Weight 305.67000
Density 1.499 g/cm3 Boiling Point 548.4ºC
Molecular Formula C14H8ClNO5 Melting Point 198-201 °C(lit.)
MSDS USA Flash Point 285.4ºC
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 2-(4-Chloro-3-nitrobenzoyl)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.499 g/cm3
Boiling Point 548.4ºC
Melting Point 198-201 °C(lit.)
Molecular Formula C14H8ClNO5
Molecular Weight 305.67000
Flash Point 285.4ºC
Exact Mass 305.00900
PSA 100.19000
LogP 3.70060
InChIKey RITAQDHCJBLSSL-UHFFFAOYSA-N
SMILES O=C(O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1

 Safety Information

Symbol GHS07
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-S37/39
RIDADR NONH for all modes of transport
WGK Germany 3
HS Code 2918300090

 Synthetic Route

~95%

2-(4-Chloro-3-nitrobenzoyl)benzoic acid Structure

2-(4-Chloro-3-n...

CAS#:85-54-1

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Literature: ANGION BIOMEDICA CORP. Patent: WO2006/36981 A2, 2006 ; Location in patent: Page/Page column 83-84 ;

 Customs

HS Code 2918300090
Summary 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

 Articles2

More Articles
Catalytic Liquid-Phase Reduction of Aromatic Nitro Compounds Containing Highly Reactive Functional Groups. Zhandarev VV, et al.

Russ. J. Org. Chem. 37(5) , 673-6, (2001)

475. Chemistry of indanthrone. Part VI. Alkylsulphonyl-indanthrones. Bradley W and Nursten HE.

J. Chem. Soc. , 2177-85, (1951)

 2-(4-Chloro-3-nitrobenzoyl)benzoic acidBioassay

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Name: Inhibition of recombinant phosphatase activity of Cdc25B catalytic domain expressed i...
Source: ChEMBL
Target: M-phase inducer phosphatase 2
External Id: CHEMBL2061427
Name: Binding affinity to hexahistidine-SUMO tagged Mycobacterium tuberculosis InhA express...
Source: ChEMBL
Target: Enoyl-[acyl-carrier-protein] reductase [NADH]
External Id: CHEMBL4405862
Name: Binding affinity to hexahistidine-SUMO tagged Mycobacterium tuberculosis InhA express...
Source: ChEMBL
Target: Enoyl-[acyl-carrier-protein] reductase [NADH]
External Id: CHEMBL4405863
Name: Binding affinity to hexahistidine-SUMO tagged Mycobacterium tuberculosis InhA express...
Source: ChEMBL
Target: Enoyl-[acyl-carrier-protein] reductase [NADH]
External Id: CHEMBL4405864
Name: Binding affinity to hexahistidine-SUMO tagged Mycobacterium tuberculosis InhA express...
Source: ChEMBL
Target: Enoyl-[acyl-carrier-protein] reductase [NADH]
External Id: CHEMBL4405865
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: Inhibition of hexahistidine-SUMO tagged Mycobacterium tuberculosis InhA expressed in ...
Source: ChEMBL
Target: Enoyl-[acyl-carrier-protein] reductase [NADH]
External Id: CHEMBL4405866
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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 Synonyms

3'-Nitro-4'-chlorobenzoylbenzoic acid
MFCD00007082
EINECS 201-613-8
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