AG002J41

20754-20-5 | 2-Propenoic acid, 3-(4-methylphenyl)-, methyl ester, (2E)-

AG002J41

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CAS Number	20754-20-5
Catalog Number	AG002J41(AGN-PC-0O7NRZ)
Chemical Name	2-Propenoic acid, 3-(4-methylphenyl)-, methyl ester, (2E)-
IUPAC Name	methyl (E)-3-(4-methylphenyl)prop-2-enoate
InChI	InChI=1S/C11H12O2/c1-9-3-5-10(6-4-9)7-8-11(12)13-2/h3-8H,1-2H3/b8-7+
InChI Key	WLJBRXRCJNSDHT-BQYQJAHWSA-N
MDL Number	MFCD00460746
Molecular Formula	C11H12O2
Molecular Weight	176.2118
SMILES	O=C(OC)C=Cc1ccc(cc1)C
Synonyms	20754-20-5, METHYL 4-METHYLCINNAMATE, Methyl 3-(p-tolyl)acrylate, (E)-methyl 3-p-tolylacrylate, WLJBRXRCJNSDHT-BQYQJAHWSA-N, methyl 3-(4-methylphenyl)acrylate, 4-Methyl cinnamic acid methyl ester, 4-Methylcinnamic acid methyl ester, 2-Propenoic acid, 3-(4-methylphenyl)-, methyl ester, (2E)-, AG-205/06379040, J-650091, Methyl trans-4-methylcinnamate, AK135124, AC1NSQYI, methyl 4-methyl cinnamate, 4-Methylcinnamic acid methyl, ghl.PD_Mitscher_leg0.364, SCHEMBL504081, methyl trans-3-p-tolylacrylate, SCHEMBL2472987, CHEMBL2252103, (E)-methyl 3-(p-tolyl)acrylate, ZINC2565641, ZX-AT015110, MFCD00460746, 4-{(E)-2-carbomethoxyethenyl}toluene, AKOS004902754, AC-6965, AN-9520, DS-4894, FCH1111626, FCH5218985, OR12660, RP17435, 4-Methylbenzeneacrylic acid methyl ester, ACM20754205, methyl (E)-3-(p-tolyl)prop-2-enoate, AJ-41147, BBV-42865929, CJ-09716, AX8032595, BB0221049, RT-001535, (E)-3-(p-tolyl)-acrylic acid methyl ester, BB 0221049, PARA-METHYLCINNAMIC ACID METHYL ESTER, Z3588, methyl (E)-3-(4-methylphenyl)prop-2-enoate, Methyl (2E)-3-(4-methylphenyl)prop-2-enoate, trans-3-(p-Tolyl)-2-propenoic acid methyl ester, I01-9543, methyl4-methylcinnamate, methyl p-methoxy cinnamate, C11H12O2, ACN-042109, CID5314312, Methyl (2E)-3-(4-methylphenyl)propenoate, 2-Propenoicacid, 3-[4-(bromomethyl)phenyl]-, methyl ester, (E)- (9CI), 88738-86-7,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	176.084g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	176.215g/mol
Monoisotopic Mass	176.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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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