4-Bromobenzoic acid

Modify Date: 2025-08-21 07:16:49

4-Bromobenzoic acid Structure
4-Bromobenzoic acid structure
 Common Name 4-Bromobenzoic acid
CAS Number 586-76-5 Molecular Weight 201.017
Density 1.7±0.1 g/cm3 Boiling Point 299.8±23.0 °C at 760 mmHg
Molecular Formula C7H5BrO2 Melting Point 252-254 °C(lit.)
MSDS Chinese USA Flash Point 135.1±22.6 °C
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name 4-bromobenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.7±0.1 g/cm3
Boiling Point 299.8±23.0 °C at 760 mmHg
Melting Point 252-254 °C(lit.)
Molecular Formula C7H5BrO2
Molecular Weight 201.017
Flash Point 135.1±22.6 °C
Exact Mass 199.947281
PSA 37.30000
LogP 2.86
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.608
Stability Stable. Incompatible with strong oxidizing agents.
Water Solubility SOLUBLE IN HOT WATER

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG4448050
CHEMICAL NAME :
Benzoic acid, p-bromo-
CAS REGISTRY NUMBER :
586-76-5
BEILSTEIN REFERENCE NO. :
1906923
LAST UPDATED :
199710
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C7-H5-Br-O2
MOLECULAR WEIGHT :
201.03
WISWESSER LINE NOTATION :
QVR DE

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1059 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 44(12),19,1979
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
536 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 44(12),19,1979

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302-H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xn:Harmful;
Risk Phrases R22;R36
Safety Phrases S26-S36-S24/25-S22-S37/39
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS DG4448050
HS Code 29163900

 Customs

HS Code 29163900

 Articles3

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Investigation of the metabolic fate of 2-, 3- and 4-bromobenzoic acids in bile-duct-cannulated rats by inductively coupled plasma mass spectrometry and high-performance liquid chromatography/inductively coupled plasma mass spectrometry/electrospray mass spectrometry.

Rapid Commun. Mass Spectrom. 19(4) , 519-24, (2005)

Inductively coupled plasma mass spectrometry (ICPMS) has been used to determine the rate and routes of excretion of bromine following the intraperitoneal administration (50 mg kg(-1)) of 2-, 3- and 4-...

Quantification of the in vitro and in vivo metabolic fates of 2-, 3-and 4-bromobenzoic acids using high temperature LC coupled to ICP-MS and linear ion trap MS. Smith CJ, et al.

Chromatographia 67(9-10) , 673-678, (2008)

 Synonyms

EINECS 209-581-7
4-Bromobenzoic acid
MFCD00002529
p-Bromobenzenecarboxylic acid
Benzoic acid, p-bromo-
Benzoic acid, 4-bromo-
p-Bromobenzoic acid
QVR DE
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Chemsrc provides 4-Bromobenzoic acid(CAS#:586-76-5) MSDS, density, melting point, boiling point, structure, formula, molecular weight etc. Articles of 4-Bromobenzoic acid are included as well.>> amp version: 4-Bromobenzoic acid

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