Home Nitriles 2-[4-Amino-3-(trifluoromethyl)phenyl]acetonitrile

2-[4-Amino-3-(trifluoromethyl)phenyl]acetonitrile

CAS No.:
854273-16-8
Catalog Number:
AG00G9M6
Molecular Formula:
C9H7F3N2
Molecular Weight:
200.1605
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$125
- +
1g
98%
In Stock USA
United States
$300
- +
5g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00G9M6
Chemical Name:
2-[4-Amino-3-(trifluoromethyl)phenyl]acetonitrile
CAS Number:
854273-16-8
Molecular Formula:
C9H7F3N2
Molecular Weight:
200.1605
MDL Number:
MFCD24448759
IUPAC Name:
2-[4-amino-3-(trifluoromethyl)phenyl]acetonitrile
InChI:
InChI=1S/C9H7F3N2/c10-9(11,12)7-5-6(3-4-13)1-2-8(7)14/h1-2,5H,3,14H2
InChI Key:
YDXIMGPJJXVQJF-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(c(c1)C(F)(F)F)N
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.056g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.164g/mol
Monoisotopic Mass:
200.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties