Home Nitriles 2-Hydroxy-5-trifluoromethylbenzonitrile

2-Hydroxy-5-trifluoromethylbenzonitrile

CAS No.:
142167-36-0
Catalog Number:
AG001HVG
Molecular Formula:
C8H4F3NO
Molecular Weight:
187.1187
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$50
- +
5g
96%
In Stock USA
United States
$150
- +
25g
96%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG001HVG
Chemical Name:
2-Hydroxy-5-trifluoromethylbenzonitrile
CAS Number:
142167-36-0
Molecular Formula:
C8H4F3NO
Molecular Weight:
187.1187
MDL Number:
MFCD11213679
IUPAC Name:
2-hydroxy-5-(trifluoromethyl)benzonitrile
InChI:
InChI=1S/C8H4F3NO/c9-8(10,11)6-1-2-7(13)5(3-6)4-12/h1-3,13H
InChI Key:
FGLWZZOKMAMVSE-UHFFFAOYSA-N
SMILES:
N#Cc1cc(ccc1O)C(F)(F)F
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.024g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.121g/mol
Monoisotopic Mass:
187.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties