200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 1266996-50-2
1266996-50-2 | [1,1'-Biphenyl]-3-carbonitrile, 3',5'-difluoro-
CAS No: 1266996-50-2 Catalog No: AG000T49 MDL No:MFCD19317325
Product Description
Catalog Number:
AG000T49
Chemical Name:
[1,1'-Biphenyl]-3-carbonitrile, 3',5'-difluoro-
CAS Number:
1266996-50-2
Molecular Formula:
C13H7F2N
Molecular Weight:
215.1982
MDL Number:
MFCD19317325
IUPAC Name:
3-(3,5-difluorophenyl)benzonitrile
InChI:
InChI=1S/C13H7F2N/c14-12-5-11(6-13(15)7-12)10-3-1-2-9(4-10)8-16/h1-7H
InChI Key:
LQGPJBUJWILMAW-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1cc(F)cc(c1)F
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.055g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.203g/mol
Monoisotopic Mass:
215.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.