AG000WME

127033-74-3 | 2-Propenamide, N-(3-methoxyphenyl)-3-phenyl-, (2E)-

AG000WME

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CAS Number	127033-74-3
Catalog Number	AG000WME(AGN-PC-0O0SXO)
Chemical Name	2-Propenamide, N-(3-methoxyphenyl)-3-phenyl-, (2E)-
IUPAC Name	(E)-N-(3-methoxyphenyl)-3-phenylprop-2-enamide
InChI	InChI=1S/C16H15NO2/c1-19-15-9-5-8-14(12-15)17-16(18)11-10-13-6-3-2-4-7-13/h2-12H,1H3,(H,17,18)/b11-10+
InChI Key	GVTLFGJNTIRUEG-ZHACJKMWSA-N
MDL Number	MFCD00684323
Molecular Formula	C16H15NO2
Molecular Weight	253.2958
SMILES	O=C(NC1=CC=CC(OC)=C1)/C=C/C2=CC=CC=C2
Synonyms	127033-74-3, m-Cinnamanisidide, N-(CINNAMOYL)-3-METHOXYANILINE, N-(3-Methoxyphenyl)Cinnamamide, (2E)-N-(3-methoxyphenyl)-3-phenylprop-2-enamide, 15116-41-3, CHEMBL2336356, (E)-N-(3-Methoxyphenyl)-3-phenyl-2-propenamide, (E)-N-(3-METHOXY-PHENYL)-3-PHENYL-ACRYLAMIDE, AK343140, AC1LGIWX, Brexpiprazole Impurity 10, 2-Propenamide, N-(3-methoxyphenyl)-3-phenyl-, SCHEMBL247432, GVTLFGJNTIRUEG-ZHACJKMWSA-N, ZINC299297, BDBM50429761, MFCD00684323, STK018620, AKOS003241002, N-(3-Methoxyphenyl)-trans-cinnamamide, N-(3-methoxyphenyl)-3-phenylacrylamide, BC201633, DS-12414, RT-014167, ST45025844, AB00081071-01, (E)-N-(3-methoxyphenyl)-3-phenylprop-2-enamide, SR-01000205159, SR-01000205159-1, (2E)-N-(3-Methoxyphenyl)-3-phenyl-2-propenamide #, 2-Propenamide, N-(3-methoxyphenyl)-3-phenyl-, (2E)-, CID795596, ZINC00299297,

Complexity	308
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	253.11g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	253.301g/mol
Monoisotopic Mass	253.11g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

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

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