Home Nitriles 4-Fluoro-2-(hydroxymethyl)benzonitrile

4-Fluoro-2-(hydroxymethyl)benzonitrile

CAS No.:
1000339-93-4
Catalog Number:
AG0000DD
Molecular Formula:
C8H6FNO
Molecular Weight:
151.1377
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$73
- +
5g
98%
In Stock USA
United States
$219
- +
25g
98%
In Stock USA
United States
$875
- +
Product Description
Catalog Number:
AG0000DD
Chemical Name:
4-Fluoro-2-(hydroxymethyl)benzonitrile
CAS Number:
1000339-93-4
Molecular Formula:
C8H6FNO
Molecular Weight:
151.1377
MDL Number:
MFCD09864693
IUPAC Name:
4-fluoro-2-(hydroxymethyl)benzonitrile
InChI:
InChI=1S/C8H6FNO/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3,11H,5H2
InChI Key:
NJSSPVGHLXWQFD-UHFFFAOYSA-N
SMILES:
OCc1cc(F)ccc1C#N
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.043g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
151.14g/mol
Monoisotopic Mass:
151.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties