2-Amino-5-bromobenzoic acid

Modify Date: 2025-08-20 12:20:38

2-Amino-5-bromobenzoic acid Structure
2-Amino-5-bromobenzoic acid structure
Common Name 2-Amino-5-bromobenzoic acid
CAS Number 5794-88-7 Molecular Weight 216.032
Density 1.8±0.1 g/cm3 Boiling Point 342.4±32.0 °C at 760 mmHg
Molecular Formula C7H6BrNO2 Melting Point 213-215 °C(lit.)
MSDS Chinese USA Flash Point 160.9±25.1 °C
Symbol GHS06
GHS06
Signal Word Danger

 Names

Name 2-Amino-5-bromobenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.8±0.1 g/cm3
Boiling Point 342.4±32.0 °C at 760 mmHg
Melting Point 213-215 °C(lit.)
Molecular Formula C7H6BrNO2
Molecular Weight 216.032
Flash Point 160.9±25.1 °C
Exact Mass 214.958176
PSA 63.32000
LogP 2.37
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.672
InChIKey CUKXRHLWPSBCTI-UHFFFAOYSA-N
SMILES Nc1ccc(Br)cc1C(=O)O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CB2557670
CHEMICAL NAME :
Anthranilic acid, 5-bromo-
CAS REGISTRY NUMBER :
5794-88-7
BEILSTEIN REFERENCE NO. :
0639028
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H6-Br-N-O2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,12,1953

 Safety Information

Symbol GHS06
GHS06
Signal Word Danger
Hazard Statements H301-H315-H319-H335
Precautionary Statements P261-P301 + P310-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard Codes Xn:Harmful
Risk Phrases R22;R36/37/38
Safety Phrases S26-S36/37-S36/37/39
RIDADR UN 2811 6.1/PG 3
WGK Germany 3
RTECS CB2557670
Hazard Class 6.1
HS Code 2942000000

 Synthetic Route

 Customs

HS Code 2922499990
Summary HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof 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:6.5% General tariff:30.0%

 Articles1

More Articles
QSAR-based solubility model for drug-like compounds.

Bioorg. Med. Chem. 18 , 7078-84, (2010)

Solubility plays a very important role in the selection of compounds for drug screening. In this context, a QSAR model was developed for predicting water solubility of drug-like compounds. First, a se...

 2-Amino-5-bromobenzoic acidBioassay

View more

Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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 Synonyms

2-amino-5-bromo-benzoicaci
Anthranilic acid,5-bromo
2-Amino-5-bromobenzoic acid
5-Bromoantharanilic Acid
EINECS 227-338-3
5-bromo-anthranilicaci
2-Amino-5-bromobenzoic
RARECHEM AL BO 1183
5-Bromo-2-aminobenzoic acid
BUTTPARK 89 7-49
MFCD00007823
2-Amino-5-bromo-benzoic acid
5-Bromoanthranilic Acid
2-amino-5-bromobrnzoic acid
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