200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 101234-96-2
101234-96-2 | 4(1H)-Pyridinone, 1-(2,2,2-trifluoroethyl)-
CAS No: 101234-96-2 Catalog No: AG00040I MDL No:
Product Description
Catalog Number:
AG00040I
Chemical Name:
4(1H)-Pyridinone, 1-(2,2,2-trifluoroethyl)-
CAS Number:
101234-96-2
Molecular Formula:
C7H6F3NO
Molecular Weight:
177.1238
IUPAC Name:
1-(2,2,2-trifluoroethyl)pyridin-4-one
InChI:
InChI=1S/C7H6F3NO/c8-7(9,10)5-11-3-1-6(12)2-4-11/h1-4H,5H2
InChI Key:
PUHMSURCUYIQMD-UHFFFAOYSA-N
SMILES:
FC(Cn1ccc(=O)cc1)(F)F
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.126g/mol
Monoisotopic Mass:
177.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.