Home Nitriles 2-fluoro-2-phenylpropanenitrile

2-fluoro-2-phenylpropanenitrile

CAS No.:
95392-12-4
Catalog Number:
AG01ACEV
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01ACEV
Chemical Name:
2-fluoro-2-phenylpropanenitrile
CAS Number:
95392-12-4
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
MDL Number:
MFCD26407969
IUPAC Name:
2-fluoro-2-phenylpropanenitrile
InChI:
InChI=1S/C9H8FN/c1-9(10,7-11)8-5-3-2-4-6-8/h2-6H,1H3
InChI Key:
LINWIJZPDPOVOQ-UHFFFAOYSA-N
SMILES:
N#CC(c1ccccc1)(F)C
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.064g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.168g/mol
Monoisotopic Mass:
149.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties