Bromoacetic acid

Modify Date: 2026-07-01 07:15:24

Bromoacetic acid Structure
Bromoacetic acid structure
 Common Name Bromoacetic acid
CAS Number 79-08-3 Molecular Weight 138.948
Density 2.0±0.1 g/cm3 Boiling Point 207.0±13.0 °C at 760 mmHg
Molecular Formula C2H3BrO2 Melting Point 46-49 °C
MSDS N/A Flash Point 79.0±19.8 °C
Symbol GHS02 GHS07
GHS02, GHS07		 Signal Word Danger

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name Bromoacetic Acid
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 2.0±0.1 g/cm3
Boiling Point 207.0±13.0 °C at 760 mmHg
Melting Point 46-49 °C
Molecular Formula C2H3BrO2
Molecular Weight 138.948
Flash Point 79.0±19.8 °C
Exact Mass 137.931641
PSA 37.30000
LogP 0.51
Vapour Pressure 0.1±0.8 mmHg at 25°C
Index of Refraction 1.506
InChIKey KDPAWGWELVVRCH-UHFFFAOYSA-N
SMILES O=C(O)CBr
Water Solubility miscible

 MSDS

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

 Toxicological Information

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AF5950000
CHEMICAL NAME :
Acetic acid, bromo-
CAS REGISTRY NUMBER :
79-08-3
BEILSTEIN REFERENCE NO. :
0506167
LAST UPDATED :
199710
DATA ITEMS CITED :
18
MOLECULAR FORMULA :
C2-H3-Br-O2
MOLECULAR WEIGHT :
138.96
WISWESSER LINE NOTATION :
QV1E

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 :
50 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - rigidity (including catalepsy)
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
114 gm/m3/30M
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 - rat
DOSE/DURATION :
100 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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
50 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 :
Rodent - mouse
DOSE/DURATION :
100 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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
66 mg/kg
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - other changes
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
>48 mg/kg
TOXIC EFFECTS :
Behavioral - ataxia Gastrointestinal - hypermotility, diarrhea Gastrointestinal - nausea or vomiting
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
>24 mg/kg
TOXIC EFFECTS :
Cardiac - EKG changes not diagnostic of specified effects Behavioral - ataxia Behavioral - somnolence (general depressed activity)
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
59900 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
45 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - rigidity (including catalepsy) Lungs, Thorax, or Respiration - respiratory stimulation
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
DNA damage
TEST SYSTEM :
Rodent - mouse Leukocyte
DOSE/DURATION :
100 umol/L
REFERENCE :
BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 30,1497,1981 *** REVIEWS *** TOXICOLOGY REVIEW APTOA6 Acta Pharmacologica et Toxicologica. (Copenhagen, Denmark) V.1-59, 1945-86. For publisher information, see PHTOEH Volume(issue)/page/year: 11,13,1955 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83731 No. of Facilities: 14 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 42 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 83731 No. of Facilities: 784 (estimated) No. of Industries: 6 No. of Occupations: 6 No. of Employees: 4874 (estimated) No. of Female Employees: 249 (estimated)

 Safety Information

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Danger
Hazard Statements H225-H315
Precautionary Statements P210-P403 + P235
Personal Protective Equipment Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes C:Corrosive
Risk Phrases R23/24/25;R35;R50
Safety Phrases S26-S36/37/39-S45-S61-S36-S16
RIDADR UN 3425 8/PG 2
WGK Germany 2
RTECS AF5950000
Packaging Group II
Hazard Class 8
HS Code 2915900090

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

 Customs

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code 2915900090
Summary 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

 Bromoacetic acidBioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

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: The compound was tested for the ability to inactivate human liver alcohol dehydrogena...
Source: ChEMBL
Target: All-trans-retinol dehydrogenase [NAD(+)] ADH1B
External Id: CHEMBL645347
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 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

Bromoacetic acid
α-bromoethanoic acid
Monobromoacetic acid
Bromoethanoic acid
Bromoaceticacid
2-bromoacetic acid
MFCD00002678
α-Bromoacetic acid
EINECS 201-175-8
QV1E

 Bromoacetic acid | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the safety information for Bromoacetic Acid?
A: Safety information for Bromoacetic Acid: S26-S36/37/39-S45-S61-S36-S16.
Q: What is the English name of Bromoacetic Acid?
A: The English name of Bromoacetic Acid is Bromoacetic Acid.
Q: How is the water solubility of Bromoacetic Acid?
A: Water solubility of Bromoacetic Acid: miscible.
Q: What is the boiling point of Bromoacetic Acid?
A: Boiling point of Bromoacetic Acid is 207.0±13.0 °C at 760 mmHg.
Q: What English synonyms does Bromoacetic Acid have?
A: English synonyms of Bromoacetic Acid: Bromoacetic acid, α-bromoethanoic acid, Monobromoacetic acid, Bromoethanoic acid, Bromoaceticacid, 2-bromoacetic acid, MFCD00002678, α-Bromoacetic acid, EINECS 201-175-8, QV1E.
Q: What is the molecular weight of Bromoacetic Acid?
A: Molecular weight of Bromoacetic Acid is 138.948.
Q: What is the InChIKey of Bromoacetic Acid?
A: InChIKey of Bromoacetic Acid is KDPAWGWELVVRCH-UHFFFAOYSA-N.
Q: What is the SMILES notation of Bromoacetic Acid?
A: SMILES notation of Bromoacetic Acid is O=C(O)CBr.
Q: What is the LogP of Bromoacetic Acid?
A: LogP of Bromoacetic Acid is 0.51.
Q: What is the polar surface area (PSA) of Bromoacetic Acid?
A: Polar surface area (PSA) of Bromoacetic Acid is 37.30000.

 Bromoacetic acidfactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Dayang Chem (Hangzhou) Co., Ltd.
Henan Tianfu Chemical Co., Ltd.
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Chemsrc provides Bromoacetic acid(CAS#:79-08-3) MSDS, density, melting point, boiling point, structure, formula, molecular weight etc. Articles of Bromoacetic acid are included as well.>> amp version: Bromoacetic acid

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