CAS 3796-23-4 | 3-(Trifluoromethyl)Pyridine | CAS Number 3796-23-4

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Fluorides > 3796-23-4

3796-23-4 | 3-(Trifluoromethyl)Pyridine

CAS No: 3796-23-4 Catalog No: AG003IB7 MDL No:MFCD00100032

Product Description

Catalog Number:

AG003IB7

Chemical Name:

3-(Trifluoromethyl)Pyridine

CAS Number:

3796-23-4

Molecular Formula:

C6H4F3N

Molecular Weight:

147.0979

MDL Number:

MFCD00100032

IUPAC Name:

3-(trifluoromethyl)pyridine

InChI:

InChI=1S/C6H4F3N/c7-6(8,9)5-2-1-3-10-4-5/h1-4H

InChI Key:

JTZSFNHHVULOGJ-UHFFFAOYSA-N

SMILES:

FC(c1cccnc1)(F)F

EC Number:

223-268-2

Properties

Complexity:

110

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

147.03g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

147.1g/mol

Monoisotopic Mass:

147.03g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

12.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7

Literature

Title	Journal
A novel, 'double-clamp' binding mode for human heme oxygenase-1 inhibition.	PloS one 20120101
X-ray crystal structure of human heme oxygenase-1 with (2R,4S)-2-[2-(4-chlorophenyl)ethyl]-2-[(1H-imidazol-1-yl)methyl]-4[((5-trifluoromethylpyridin-2-yl)thio)methyl]-1,3-dioxolane: a novel, inducible binding mode.	Journal of medicinal chemistry 20090813
Carbon dioxide/epoxide coupling reactions utilizing Lewis base adducts of zinc halides as catalysts. Cyclic carbonate versus polycarbonate production.	Inorganic chemistry 20030127