3-Aminobenzoic acid

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Names

[ CAS No. ]:
99-05-8

[ Name ]:
3-Aminobenzoic acid

[Synonym ]:
3-Aminobenzoic acid
Benzoic acid, m-amino-
Benzoic acid, 3-amino-
3-Aminobenzoesaeure
m-carboxyaniline
EINECS 202-724-4
m-aminobenzoic acid
MFCD00007795
m-Aminobenzoesaeure

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
352.5±25.0 °C at 760 mmHg

[ Melting Point ]:
178-180 °C(lit.)

[ Molecular Formula ]:
C7H7NO2

[ Molecular Weight ]:
137.136

[ Flash Point ]:
167.0±23.2 °C

[ Exact Mass ]:
137.047684

[ PSA ]:
63.32000

[ LogP ]:
0.78

[ Vapour Pressure ]:
0.0±0.8 mmHg at 25°C

[ Index of Refraction ]:
1.637

[ Water Solubility ]:
5.9 g/L (15 ºC)

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG1225000
CHEMICAL NAME :
Benzoic acid, m-amino-
CAS REGISTRY NUMBER :
99-05-8
BEILSTEIN REFERENCE NO. :
0471603
LAST UPDATED :
199710
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C7-H7-N-O2
MOLECULAR WEIGHT :
137.15
WISWESSER LINE NOTATION :
ZR CVQ

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 :
6300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
QJPPAL Quarterly Journal of Pharmacy & Pharmacology. (London, UK) V.2-21, 1929-48. For publisher information, see JPPMAB. Volume(issue)/page/year: 19,483,1946
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,53,1954
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Bird - wild bird species
DOSE/DURATION :
750 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AECTCV Archives of Environmental Contamination and Toxicology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 070944) V.1- 1973- Volume(issue)/page/year: 12,355,1983

Safety Information

[ Symbol ]:

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 ]:
Xi:Irritant

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
DG1225000

[ HS Code ]:
29224995

Synthetic Route

Precursor & DownStream

Precursor

  • 3-Nitrobenzoic acid
  • 3-Carboxyphenylboronic acid
  • 3-azidobenzoic acid
  • 3-Iodobenzoic acid
  • 3-Aminobenzonitrile
  • 3-Toluidine
  • 3-benzylamino-benzoic acid
  • 3-Aminophthalic acid
  • 4-Aminophthalic acid
  • 4-Nitrophthalic acid

DownStream

  • 3-[[4-[(3-carboxyphenyl)iminomethyl]phenyl]methylideneamino]benzoic acid
  • Ethyl-3-iodobenzoate
  • 3-Fluorobenzoic acid
  • 3-Amino-N,N-dimethylbenzamide
  • 3-Aminobenzamide
  • 3-(1,3,4-oxadiazol-2-yl)aniline
  • 3-(Trifluoromethyl)benzoic acid
  • 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid
  • 1-(3-Carboxyphenyl)-2-thiourea
  • Benzoic acid,3-phosphono-

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%

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Related Compounds

  • 3-Aminobenzoic acid
  • 3-Aminobenzoic acid-d4
  • BOC-3-AMINOBENZOIC ACID
  • 3-aminobenzoic acid-OBzl
  • fmoc-3-aminobenzoic acid
  • 3-Aminobenzoic acid sodium
  • N4-(3-methoxyphenyl)-N6-[(oxolan-2-yl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
  • Ethyl8-fluoro-1-naphthoate
  • 5-(Aminomethyl)indolin-2-one acetate
  • 10-(3-Bromopropyl)-2-(trifluoromethyl)-10H-phenothiazine
  • 2-[4-(2-Fluorophenyl)piperazin-1-yl]ethanamine
  • 1-C-Carboxy-alpha-D-glucopyranose
  • 4-Ethoxy-benzo[a]phenazine-11-carboxylic acid
  • 4-[(1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluorohexyl)oxy]benzoic acid
  • 5-((5-Carboxy-3-ethyl-4-methyl-1H-pyrrol-2-yl)methyl)-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid
  • 1-Chloro-4-methylhexane
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