3-Aminobenzonitrile
Names
[ CAS No. ]:
2237-30-1
[ Name ]:
3-Aminobenzonitrile
[Synonym ]:
3-Aminobenzonitrile
1-amino-3-cyanobenzene
3-Cyanoaniline
3-Amino-benzonitrile
Benzonitrile, 3-amino-
M-AMINOBENZONITRILE
m-Cyanoaniline
MFCD00007756
3-aminobenzonitril
EINECS 218-800-5
3-Aminobenzolcarbonitril
3-cyanophenylamine
Benzonitrile,3-amino
m-cyanophenyl amine
Benzonitrile,m-amino
m-Anthranilonitrile
meta-cyanoaniline
Chemical & Physical Properties
[ Density]:
1.1±0.1 g/cm3
[ Boiling Point ]:
290.0±13.0 °C at 760 mmHg
[ Melting Point ]:
48-53 °C(lit.)
[ Molecular Formula ]:
C7H6N2
[ Molecular Weight ]:
118.136
[ Flash Point ]:
129.2±19.8 °C
[ Exact Mass ]:
118.053101
[ PSA ]:
49.81000
[ LogP ]:
1.07
[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C
[ Index of Refraction ]:
1.590
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DI2454000
- CHEMICAL NAME :
- Benzonitrile, m-amino-
- CAS REGISTRY NUMBER :
- 2237-30-1
- BEILSTEIN REFERENCE NO. :
- 0636498
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C7-H6-N2
- MOLECULAR WEIGHT :
- 118.15
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Bird - quail
- DOSE/DURATION :
- 562 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 :
- Bird - wild bird species
- DOSE/DURATION :
- 562 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA
- TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Salmonella typhimurium
- DOSE/DURATION :
- 100 mg/L
- REFERENCE :
- ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 5,803,1983
Safety Information
[ Symbol ]:
GHS07
[ Signal Word ]:
Warning
[ Hazard Statements ]:
H302 + H312 + H332-H317
[ Precautionary Statements ]:
P280
[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Faceshields;Gloves
[ Hazard Codes ]:
Xn:Harmful;
[ Risk Phrases ]:
R22
[ Safety Phrases ]:
S36/37
[ RIDADR ]:
3276
[ WGK Germany ]:
3
[ RTECS ]:
DI2454000
[ Packaging Group ]:
III
[ Hazard Class ]:
6.1
[ HS Code ]:
2926909090
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2926909090
[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
Articles
Bioorg. Med. Chem. 13(22) , 6158-66, (2005)
3-Aminobenzonitrile and 2-amino-4-phenyl thiazole on condensation with 4-isothiocyanato-4-methyl pentane-2-one gave condensed monocyclic pyrimidine derivatives 1 and 2, 3, respectively. Condensation o...
Synthesis and biological evaluation of 1-substituted-3(5)-(6-methylpyridin-2-yl)-4-(quinoxalin-6-yl)pyrazoles as transforming growth factor-β type 1 receptor kinase inhibitors.Eur. J. Med. Chem. 46(9) , 3917-25, (2011)
A series of 1-substituted-3(5)-(6-methylpyridin-2-yl)-4-(quinoxalin-6-yl)pyrazoles 14a-d, 15a-d, 17a, 17b, 18a-d, 19a, and 19b has been synthesized and evaluated for their ALK5 inhibitory activity in ...
Preparation of highly substituted gamma-lactam follicle stimulating hormone receptor agonists.Bioorg. Med. Chem. 13(21) , 5986-95, (2005)
An unusual combination of Weinreb amidation and Mitsunobu lactam formation was used to prepare highly substituted gamma-lactam analogues of a thiazolidinone follicle stimulating hormone receptor agoni...