200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 167306-96-9
167306-96-9 | Benzonitrile, 2,6-difluoro-4-(trans-4-propylcyclohexyl)-
CAS No: 167306-96-9 Catalog No: AG001XAM MDL No:
Product Description
Catalog Number:
AG001XAM
Chemical Name:
Benzonitrile, 2,6-difluoro-4-(trans-4-propylcyclohexyl)-
CAS Number:
167306-96-9
Molecular Formula:
C16H19F2N
Molecular Weight:
263.3256
IUPAC Name:
2,6-difluoro-4-(4-propylcyclohexyl)benzonitrile
InChI:
InChI=1S/C16H19F2N/c1-2-3-11-4-6-12(7-5-11)13-8-15(17)14(10-19)16(18)9-13/h8-9,11-12H,2-7H2,1H3
InChI Key:
KTBIKJACWUFHMI-UHFFFAOYSA-N
SMILES:
CCC[C@@H]1CC[C@H](CC1)c1cc(F)c(c(c1)F)C#N
EC Number:
605-474-8
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.149g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.332g/mol
Monoisotopic Mass:
263.149g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.