AG002M69

2309-07-1 | 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester

AG002M69

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CAS Number	2309-07-1
Catalog Number	AG002M69(AGN-PC-0JKD46)
Chemical Name	2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester
EC Number	606-986-4
IUPAC Name	methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
InChI	InChI=1S/C11H12O4/c1-14-10-7-8(3-5-9(10)12)4-6-11(13)15-2/h3-7,12H,1-2H3/b6-4+
InChI Key	AUJXJFHANFIVKH-GQCTYLIASA-N
MDL Number	MFCD00017208
Molecular Formula	C11H12O4
Molecular Weight	208.2106
NSC Number	74548
SMILES	OC1=C(C=C(C=C1)C=CC(=O)OC)OC
UNII	Y98BUA66RX
Synonyms	methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)acrylate, methyl ferulate, Methyl ferulate, 2309-07-1, Ferulic acid methyl ester, methyl 3-(4-hydroxy-3-methoxyphenyl)acrylate, 22329-76-6, Ferulic acid methylester, methyl 4-hydroxy-3-methoxycinnamate, trans-methylferulate, CHEBI:67379, CINNAMIC ACID, 4-HYDROXY-3-METHOXY-, METHYL ESTER, 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester, UNII-Y98BUA66RX, Y98BUA66RX, trans-Ferulic acid methyl ester, AUJXJFHANFIVKH-GQCTYLIASA-N, NSC 74548, NSC-74548, Methyl 4'-hydroxy-3'-methoxycinnamate, BRN 2731141, methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate, methyl (E)-4-hydroxy-3-methoxycinnamate, AI3-23713, 2-propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester, (2E)-, EN300-28623, methyl (E)-3-(4-hydroxy-3-methoxyphenyl)acrylate, Methyl (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate, methyl trans-ferulate, ferulic-acid-methylester, AC1NSAI3, Methyl ferulate, (E)-, bmse000609, bmse010229, CHEMBL32969, Methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)acrylate, AC1Q41K7, ALBB-026142, NSC74548, ZINC1621053, SBB059306, STK665368, AKOS003404666, AKOS025310509, CS-W019429, GS-3694, HY-W018643, MCULE-7084750759, AJ-28336, CJ-05793, LS-54118, AB1009461, ST2413323, ST4134741, TC-133591, 4-hydroxy-3-methoxy-cinnamic acid methyl ester, (E)-4-hydroxy-3-methoxycinnamic acid methyl ester, (E)4-hydroxy-3-methoxycinnamic acid methyl ester, 309F071, 4-10-00-01779 (Beilstein Handbook Reference), methyl(E)-3-(4-hydroxy-3-methoxyphenyl)acrylate, I01-8171, J-014979, 4-HYDROXY-3-METHOXYCINNAMIC ACID METHYL ESTER, methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate, methyl(2e)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, Methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, Methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate #, methyl (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate, 3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid methyl ester, 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester (9CI), 2-Propenoic acid,3-(4-hydroxy-3-methoxyphenyl)-, methyl ester, (2E)-, Ferulic acid methyl ester; 4-Hydroxy-3-methoxycinnamic acid methyl ester; Methyl 3-(4-hydroxy-3-methoxyphenyl)acrylate, methyl ferulic acid, FERULICACIDMETHYLESTER, 2-Propenoic acid, methyl ester, CINNAMIC ACID, METHYL ESTER, Ethyl 4-hydroxy-3-methoxycinnamate, C11H12O4, MFCD00017208, CID5357283, M-5000, C530806, 16980-82-8,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	208.074g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	208.213g/mol
Monoisotopic Mass	208.074g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number