3-aminobenzotrifluoride

Modify Date: 2024-01-12 12:07:09

3-aminobenzotrifluoride Structure
3-aminobenzotrifluoride structure
Common Name 3-aminobenzotrifluoride
CAS Number 5098-16-8 Molecular Weight 123.11300
Density 1.29 g/mL at 25ºC(lit.) Boiling Point 187ºC(lit.)
Molecular Formula C5H5N3O Melting Point 5-6ºC(lit.)
MSDS N/A Flash Point 185 °F

 Names

Name 5-Amino-2-methyloxazole-4-carbonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.29 g/mL at 25ºC(lit.)
Boiling Point 187ºC(lit.)
Melting Point 5-6ºC(lit.)
Molecular Formula C5H5N3O
Molecular Weight 123.11300
Flash Point 185 °F
Exact Mass 123.04300
PSA 75.84000
LogP 1.01808
Vapour Pressure 0.3 mm Hg ( 20 °C)
Index of Refraction n20/D 1.480(lit.)
Storage condition 2-8°C

 Safety Information

Hazard Codes T+
Risk Phrases 22-24-26-33
Safety Phrases 36/37/39-45
RIDADR UN 2948 6.1/PG 2
WGK Germany 2
RTECS XU9180000
HS Code 2934999090

 Synthetic Route

~61%

3-aminobenzotrifluoride Structure

3-aminobenzotri...

CAS#:5098-16-8

Literature: Freeman, Fillmore; Kim, Darrick S. H. L. Tetrahedron Letters, 1989 , vol. 30, # 20 p. 2631 - 2632

~%

3-aminobenzotrifluoride Structure

3-aminobenzotri...

CAS#:5098-16-8

Literature: Ferris,J.P.; Orgel,L.E. Journal of the American Chemical Society, 1966 , vol. 88, p. 3829 - 3831

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

MFCD00007797
5-amino-2-methyl-1,3-oxazole-4-carbonitrile
EINECS 202-643-4