AG0035L5

530-59-6 | 4-Hydroxy-3,5-dimethoxycinnamic acid

AG0035L5

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CAS Number	530-59-6
Catalog Number	AG0035L5(AGN-PC-007GQ5)
Chemical Name	4-Hydroxy-3,5-dimethoxycinnamic acid
EC Number	208-487-3
IUPAC Name	(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid
InChI	InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+
InChI Key	PCMORTLOPMLEFB-ONEGZZNKSA-N
MDL Number	MFCD00004401
Molecular Formula	C11H12O5
Molecular Weight	224.2100
NSC Number	59261
SMILES	OC1=C(C=C(C=CC(=O)O)C=C1OC)OC
UNII	P0I60993EC
Synonyms	(E)-sinapic acid, 2-propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, 3,5-dimethoxy-4-hydroxycinnamic acid, 4-hydroxy-3,5-dimethoxycinnamic acid, cinnamic acid, 4-hydroxy-3,5-dimethoxy-, (E)-, sinapic acid, sinapic acid, (E)-, sinapinic acid, synapitic acid, trans-sinapic acid, trans-sinapinic acid, SINAPIC ACID, Sinapinic acid, 530-59-6, 3,5-Dimethoxy-4-hydroxycinnamic acid, SINAPINATE, Sinapate, Synapoic acid, 4-Hydroxy-3,5-dimethoxycinnamic acid, trans-sinapic acid, (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid, MFCD00004401, (E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid, UNII-P0I60993EC, 2-Propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, Cinnamic acid, 4-hydroxy-3,5-dimethoxy-, (E)-, (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid, CHEMBL109341, 3,5-dimethoxy-4-hydroxy-trans-cinnamic acid, CHEBI:15714, PCMORTLOPMLEFB-ONEGZZNKSA-N, P0I60993EC, NSC59261, (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid, 4-Hydroxy-3,5-dimethoxy-cinnamic acid, 2-Propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, (E)-, trans-3,5-Dimethoxy-4-hydroxycinnamic acid, 7362-37-0, SXX, W-105777, 3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-Propenoic acid, (2E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-(E)-2-propenoic acid, 2-propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, (2E)-, (E)-Sinapic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid, sinapinic-acid, Sinapic_acid, 3,5-Dimethoxy-4-hydroxycinnamic acid, 98%, predominantly trans isomer, AK-29344, Sinapic acid, trans-, 3,5-DIMETHOXY-4-HYDROXY CINNAMIC ACID, AC1LCUXW, bmse000318, bmse000594, bmse010209, AC1Q47EG, SCHEMBL37312, MLS001066354, Sinapic acid, >=98%, powder, CHEBI:77131, BIS8112, ZX-AFC000604, HMS2230P08, ZINC153654, BCP25316, ZX-AT021035, BBL036684, BDBM50341142, NSC-59261, OR1178, SBB061895, AKOS015851820, 3, 5-dimethoxy-4-hydroxycinnamic acid, CCG-214595, CD-1325, CS-W010448, DB08587, HY-W009732, MS-8962, RP27516, RTX-012048, trans-Sinapic acid, analytical standard, NCGC00247028-01, AJ-13047, AN-45615, SC-13259, SMR000471879, ST098710, Cinnamic acid, 4-hydroxy-3,5-dimethoxy-, SBI-0206696.P002, AB0020603, AB1009201, 4-Hydroxy-3,5-dimethoxy-(E)-Cinnamic acid, ST24041243, V1546, EN300-93177, C00482, J10227, K-9641, 3-(4-hydroxy-3,5-dimethoxy-phenyl)-acrylic acid, I01-5955, BRD-K95487349-001-04-2, (E)-3-(4-Hydroxy-3,5-dimethoxy-phenyl)-acrylic acid, 3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid #, (E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoic acid, (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid, 3-(4-Hydroxy-3,5-dimethoxyphenyl)-(2E)-2-Propenoic acid, 7AE78999-D500-492B-9651-46622E8DAA71, Sinapic acid, matrix substance for MALDI-MS, >=99.0% (T), UNII-68A28V6010 component PCMORTLOPMLEFB-ONEGZZNKSA-N, Sinapic acid, matrix substance for MALDI-MS, >=99.5%, Ultra pure, 3,5-Dimethoxy-4-hydroxycinnamic acid; 4-Hydroxy-3,5-dimethoxy-cinnamic acid; Sinapinic acid, InChI=1/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3, synapitic acid, Sinapoyl alcohol, trans-sinapinic acid, sinapic acid, (E)-, C11H12O5, UNII-68A28V6010, EINECS 208-487-3, 4-Hydroxy-3,5-dimethoxycinnamicacid, CID637775, NSC 59261, ACN-043199, C11-H12-O5, CB11829, 3-(3,4,5-trimethoxyphenyl)acrylic acid, 3,5-DIMETHOXY-4-HYDROXYCINNAMICACID, trans-3',5'-Dimethoxy-4'-hydroxyzimtsaure, C073734, trans-3-(3,5-Dimethoxy-4-hydroxyphenyl)propensaure, 3,5-Dimethoxy-4-hydroxycinnamic acid, 98%, predominantly trans isomer - 1G 1g,

Complexity	249
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	224.068g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	224.212g/mol
Monoisotopic Mass	224.068g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	76A^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