AG00DIJ9

5453-48-5 | N-(4-CHLOROPHENYL) ACRYLAMIDE

AG00DIJ9

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CAS Number	5453-48-5
Catalog Number	AG00DIJ9(AGN-PC-00TPRG)
Chemical Name	N-(4-CHLOROPHENYL) ACRYLAMIDE
IUPAC Name	N-(4-chlorophenyl)prop-2-enamide
InChI	InChI=1S/C9H8ClNO/c1-2-9(12)11-8-5-3-7(10)4-6-8/h2-6H,1H2,(H,11,12)
InChI Key	JEPAGMKWFWQECH-UHFFFAOYSA-N
MDL Number	MFCD00045201
Molecular Formula	C9H8ClNO
Molecular Weight	181.6189
NSC Number	18608
SMILES	C=CC(NC1=CC=C(Cl)C=C1)=O
Synonyms	N-(4-Chlorophenyl)acrylamide, 5453-48-5, n-(4-chlorophenyl)prop-2-enamide, NSC18608, AC1L5FCN, AC1Q3OGU, N-(p-chlorophenyl)acrylamide, SCHEMBL1381911, CTK8C1010, DTXSID10280790, ZINC1561525, 7891AB, ANW-65712, MFCD00045201, NSC-18608, AKOS003287443, AM87053, MCULE-5825357915, NE30888, VS-0091, AJ-27053, CJ-24538, DB-052600, TC-154457, FT-0635727, Z1852289473, N- ACRYLAMIDE, C9H8ClNO, AR-1J9123, CID227241, 6313-38-8,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	181.619g/mol
Monoisotopic Mass	181.029g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

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

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