Home Nitriles 4-(2-fluoro-1-hydroxyethyl)benzonitrile

4-(2-fluoro-1-hydroxyethyl)benzonitrile

CAS No.:
1073056-22-0
Catalog Number:
AG01DX9W
Molecular Formula:
C9H8FNO
Molecular Weight:
165.1643
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DX9W
Chemical Name:
4-(2-fluoro-1-hydroxyethyl)benzonitrile
CAS Number:
1073056-22-0
Molecular Formula:
C9H8FNO
Molecular Weight:
165.1643
MDL Number:
MFCD31666888
IUPAC Name:
4-(2-fluoro-1-hydroxyethyl)benzonitrile
InChI:
InChI=1S/C9H8FNO/c10-5-9(12)8-3-1-7(6-11)2-4-8/h1-4,9,12H,5H2
InChI Key:
YWDWJWQHEJOOSI-UHFFFAOYSA-N
SMILES:
FCC(c1ccc(cc1)C#N)O
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
165.167g/mol
Monoisotopic Mass:
165.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties