AG00C4SB

25522-33-2 | (E)-3'-hydroxy-4'-methoxycinnamic acid

AG00C4SB

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CAS Number	25522-33-2
Catalog Number	AG00C4SB(AGN-PC-0O8B4C)
Chemical Name	(E)-3'-hydroxy-4'-methoxycinnamic acid
IUPAC Name	(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid
InChI	InChI=1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
InChI Key	QURCVMIEKCOAJU-HWKANZROSA-N
MDL Number	MFCD00004391
Molecular Formula	C10H10O4
Molecular Weight	194.1840
NSC Number	51987
SMILES	O=C(O)/C=C/C1=CC=C(OC)C(O)=C1
UNII	XSQ2K2G7MC
Synonyms	3-hydroxy-4-methoxycinnamic acid, isoferulic acid, Isoferulic acid, 3-Hydroxy-4-methoxycinnamic acid, 537-73-5, Hesperetic acid, 3-(3-Hydroxy-4-methoxyphenyl)acrylic acid, 25522-33-2, Isoferulate, (2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid, Hesperetate, (E)-3-(3-hydroxy-4-methoxyphenyl)acrylic acid, 2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)-, 3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid, 3-hydroxy-4-methoxy-cinnamic acid, CHEMBL233295, CHEBI:27794, QURCVMIEKCOAJU-HWKANZROSA-N, MFCD00004391, UNII-XSQ2K2G7MC, Cinnamic acid, 3-hydroxy-4-methoxy-, Q-100609, 3-(3-Hydroxy-4-methoxyphenyl)-2-propenoic acid, XSQ2K2G7MC, Isoferulasaure, isoferulic-acid, AK-88788, EINECS 247-071-6, trans-Isoferulic acid, PubChem8187, (E)-3'-Hydroxy-4'-methoxycinnamic acid, Isoferulic Acid ,(S), AC1LEHK0, AC1Q5RAQ, bmse000618, 3-Hydroxy-4-methoxycinnamate, MLS000563054, SCHEMBL249041, SCHEMBL249042, 3-hydroxy-4-methoxy-Cinnamate, AC1Q5T96, GTPL7980, 3-Hydroxy-4-methoxycinnamic-acid, HMS2268G06, ZINC156055, AC1Q4690, AC1Q4691, HY-N0761, NSC51987, STR05122, BBL036268, BDBM50241245, CI-177, FCH089654, NSC-51987, SBB042817, STL186177, AKOS000141174, BBV-025077, CS-W020120, DB07109, FCH3451845, MCULE-7013523945, RP25302, 2-Hydoxy-4-methoxy-5-sulfobenzophenone, NCGC00247490-01, AJ-13677, MS-11465, SC-05161, SMR001215828, ST098721, trans-Isoferulic acid, analytical standard, AB0019799, AX8011852, AX8329161, ST2404733, TX-011905, 3-(3-hydroxy-4-methoxyphenyl)-2-Propenoate, 4CH-004345, AM20040660, N1393, V0307, EN300-50983, C10470, M-2347, (E)-3-(3-hydroxy-4-methoxy-phenyl)-acrylic acid, 537H735, I01-2711, (E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid, 3-Hydroxy-4-methoxycinnamic acid, predominantly trans, Z2693271860, (2E)-3-(3-Hydroxy-4-methoxyphenyl)-2-propenoic acid #, 2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)-, (2E)-, 2-Propenoic acid,3-(3-hydroxy-4-methoxyphenyl)-, (2E)-, 3-Hydroxy-4-methoxycinnamic acid, predominantly trans, 97%, 4FE, ferulic acid, D04EWW, 3-Hydroxy-4-methoxycinnamicacid, C10H10O4, Isoferulic acid, 98% - 1G 1g, EINECS 208-676-0, AR-1E6614, AR-1F3640, CID736186, NSC 51987, ACN-035729, C10-H10-O4, BRN 2212760, H0524, 4-10-00-01777 (Beilstein Handbook Reference), C008180, 5399-33-7, 5467-34-5,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	194.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	194.186g/mol
Monoisotopic Mass	194.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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