[2-Amino-5-(methyloxy)phenyl](4-chlorophenyl)methanone - CAS 91713-54-1

Catalog:	BB061432
Product Name:	[2-Amino-5-(methyloxy)phenyl](4-chlorophenyl)methanone
CAS:	91713-54-1
Synonyms:	(2-amino-5-methoxyphenyl)(4-chlorophenyl)methanone; [2-amino-5-(methyloxy)phenyl](4-chlorophenyl)methanone; (2-amino-5-methoxyphenyl)-(4-chlorophenyl)methanone; Methanone, (2-amino-5-methoxyphenyl)(4-chlorophenyl)-

Technical Data

IUPAC Name:	(2-amino-5-methoxyphenyl)-(4-chlorophenyl)methanone
Description:	[2-Amino-5-(methyloxy)phenyl](4-chlorophenyl)methanone, can be used in the synthesis of inflammatory agents, such as acetylated histones mimic compound, and 2-amino-3-benzoylphenylacetic acid and analogs.
Molecular Weight:	261.7
Molecular Formula:	C14H12ClNO2
Canonical SMILES:	COC1=CC(=C(C=C1)N)C(=O)C2=CC=C(C=C2)Cl
InChI:	InChI=1S/C14H12ClNO2/c1-18-11-6-7-13(16)12(8-11)14(17)9-2-4-10(15)5-3-9/h2-8H,16H2,1H3
InChI Key:	MIQUXYBYLZSOIJ-UHFFFAOYSA-N

Complexity:	290
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	261.0556563
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	261.0556563
Rotatable Bond Count:	3
Topological Polar Surface Area:	52.3Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4