CAS 51336-94-8 | 2-Chloro-1-(2,4-difluorophenyl)ethanone | CAS Number 51336-94-8

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Carboxes > 51336-94-8

51336-94-8 | 2-Chloro-1-(2,4-difluorophenyl)ethanone

CAS No: 51336-94-8 Catalog No: AG003374 MDL No:MFCD00013252

Product Description

Catalog Number:

AG003374

Chemical Name:

2-Chloro-1-(2,4-difluorophenyl)ethanone

CAS Number:

51336-94-8

Molecular Formula:

C8H5ClF2O

Molecular Weight:

190.5745

MDL Number:

MFCD00013252

IUPAC Name:

2-chloro-1-(2,4-difluorophenyl)ethanone

InChI:

InChI=1S/C8H5ClF2O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H2

InChI Key:

UENGBOCGGKLVJJ-UHFFFAOYSA-N

SMILES:

ClCC(=O)c1ccc(cc1F)F

EC Number:

620-343-5

Properties

Complexity:

174

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.574g/mol

Monoisotopic Mass:

190g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4

Literature

Title	Journal
Enantioselective nitrile anion cyclization to substituted pyrrolidines. A highly efficient synthesis of (3S,4R)-N-tert-butyl-4-arylpyrrolidine-3-carboxylic acid.	The Journal of organic chemistry 20050429
alpha-bromoacetophenone derivatives as neutral protein tyrosine phosphatase inhibitors: structure-Activity relationship.	Bioorganic & medicinal chemistry letters 20021104