200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 425702-28-9
425702-28-9 | 4,5-Difluoro-2-methoxybenzonitrile
CAS No: 425702-28-9 Catalog No: AG003KHU MDL No:MFCD06660346
Product Description
Catalog Number:
AG003KHU
Chemical Name:
4,5-Difluoro-2-methoxybenzonitrile
CAS Number:
425702-28-9
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
MDL Number:
MFCD06660346
IUPAC Name:
4,5-difluoro-2-methoxybenzonitrile
InChI:
InChI=1S/C8H5F2NO/c1-12-8-3-7(10)6(9)2-5(8)4-11/h2-3H,1H3
InChI Key:
HACKETIBYOIPCJ-UHFFFAOYSA-N
SMILES:
COc1cc(F)c(cc1C#N)F
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.034g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.131g/mol
Monoisotopic Mass:
169.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.