2'-Chloropropiophenone - CAS 6323-18-8

Catalog:	BB032064
Product Name:	2'-Chloropropiophenone
CAS:	6323-18-8
Synonyms:	1-(2-chlorophenyl)-1-propanone; 1-(2-chlorophenyl)propan-1-one

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(2-chlorophenyl)propan-1-one
Description:	2'-Chloropropiophenone (CAS# 6323-18-8) is a useful research chemical.
Molecular Weight:	168.62
Molecular Formula:	C9H9ClO
Canonical SMILES:	CCC(=O)C1=CC=CC=C1Cl
InChI:	InChI=1S/C9H9ClO/c1-2-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3
InChI Key:	BTSCBJDORATYKJ-UHFFFAOYSA-N
MDL:	MFCD07787256
LogP:	2.93270

Publication Number	Title	Priority Date
CN-109232468-A	A kind of camphorsulfonic acid thiosemicarbazones thiazole compound, preparation method and its application	20181106
JP-2018177659-A	Process for producing decane-1,10-dicarbonimide	20170406
US-10189836-B2	Therapeutic compounds, compositions and methods of use thereof	20151218
CA-2979926-A1	Substituted n-bicyclo-2-aryl-quinolin-4-carboxamides and use thereof	20150318
EP-3271334-A1	Substituted n-bicyclo-2-aryl-quinolin-4-carboxamides and use thereof	20150318

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Complexity:	145
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	168.0341926
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	168.0341926
Rotatable Bond Count:	2
Topological Polar Surface Area:	17.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6