AG00CITD

39061-72-8 | 1-(2-Amino-4-chlorophenyl)ethanone

AG00CITD

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CAS Number	39061-72-8
Catalog Number	AG00CITD(AGN-PC-00N4L0)
Chemical Name	1-(2-Amino-4-chlorophenyl)ethanone
IUPAC Name	1-(2-amino-4-chlorophenyl)ethanone
InChI	InChI=1S/C8H8ClNO/c1-5(11)7-3-2-6(9)4-8(7)10/h2-4H,10H2,1H3
InChI Key	YJWZHHLRVPCSGP-UHFFFAOYSA-N
MDL Number	MFCD12025287
Molecular Formula	C8H8ClNO
Molecular Weight	169.6082
SMILES	CC(C1=CC=C(Cl)C=C1N)=O
Synonyms	1-(2-amino-4-chlorophenyl)ethanone, 39061-72-8, 1-(2-Amino-4-chloro-phenyl)-ethanone, Ethanone, 1-(2-amino-4-chlorophenyl)-, 4'-Chloro-2'-aminoacetophenone, SCHEMBL400044, 2'-Amino-4'-chloroacetophenone, KS-00000PBQ, YJWZHHLRVPCSGP-UHFFFAOYSA-N, MFCD12025287, ZINC34091825, 1-(2-amino-4-chlorophenyl)-ethanone, AKOS014245540, 1-(2-amino-4-chlorophenyl)ethan-1-one, AJ-86924, AK-38009, DS-13137, Z-9272, 58810-EP2305682A1, 58810-EP2308879A1, cc-255,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	169.029g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	169.608g/mol
Monoisotopic Mass	169.029g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	43.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number