AG00BC3V

20329-98-0 | 3,4,5-Trimethoxycinnamic Acid

AG00BC3V

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CAS Number	20329-98-0
Catalog Number	AG00BC3V(AGN-PC-0O7A9V)
Chemical Name	3,4,5-Trimethoxycinnamic Acid
EC Number	201-999-8
IUPAC Name	(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid
InChI	InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+
InChI Key	YTFVRYKNXDADBI-SNAWJCMRSA-N
MDL Number	MFCD00004388
Molecular Formula	C12H14O5
Molecular Weight	238.2366
NSC Number	66175
SMILES	COC=1C=C(C=C(C1OC)OC)/C=C/C(=O)O
UNII	C9096D920O
Synonyms	3,4,5-trimethoxycinnamic acid, 3-(3,4,5-trimethoxyphenyl)-2-propenoic acid, 3,4,5-TRIMETHOXYCINNAMIC ACID, 90-50-6, O-Methylsinapic acid, 20329-98-0, 3,4,5-Trimethoxyphenylacrylic acid, 3-(3,4,5-trimethoxyphenyl)acrylic acid, NSC 66175, 3-(3,4,5-Trimethoxyphenyl)-2-propenoic acid, SINAPIC ACID METHYL ETHER, 3,4,5-Trimethoxy cinnamic acid, Cinnamic acid, 3,4,5-trimethoxy-, EINECS 201-999-8, (2E)-3-(3,4,5-trimethoxyphenyl)acrylic acid, MFCD00004388, 3,4,5-Trimethoxy-trans-cinnamic acid, (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid, BRN 1537834, (2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid, 2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, (2E)-, UNII-C9096D920O, YTFVRYKNXDADBI-SNAWJCMRSA-N, (E)-3-(3,4,5-trimethoxyphenyl)acrylic acid, NSC66175, NSC-66175, 2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, C9096D920O, 3,4,5-Trimethoxycinnamic acid, predominantly trans, W-100329, 3,4,5-Trimethoxycinnamate, SMR000371917, CHEBI:566519, O-Methylsinapate, o-methylsinapicacid, AK-43306, trans-3,4,5-Trimethoxycinnamic acid, PubChem8300, trimethoxycinnamic-acid, AC1LEGKZ, rarechem bk hc t328, AC1Q5RAK, Spectrum5_000448, bmse010224, AC1Q5T8W, 3,5-Trimethoxycinnamic acid, 3,4,5-Trimethoxy cinnamate, BSPBio_002796, SPECTRUM290032, 2-10-00-00354 (Beilstein Handbook Reference), MLS000757621, MLS002207275, SCHEMBL207441, 3,4,5-trimethoxy-cinnamicaci, CHEMBL501235, Cinnamic acid,4,5-trimethoxy-, 3,4,5-Trimethoxyphenylacrylate, otava-bb bb7119152925, DTXSID7059010, 3,4,5-trimethoxyphenylacrylicacid, BDBM232204, HMS2232E22, ZINC152561, 3, 4, 5-Trimethoxycinnamic Acid, ALBB-007558, BB_NC-00387, ZX-AN007080, ZX-AT009367, 3,4,5-Trimethoxybenzeneacrylic acid, BBL011951, CCG-39479, CT-191, HTS001488, KM2928, OR6576, SBB038595, STK500969, AKOS000120453, 3,4,5-Trimethoxycinnamic acid, 97%, BS-4465, CS-W012839, HY-W012123, MCULE-8351376607, RP09331, RTR-030993, SDCCGMLS-0066950.P001, 3,4,5-Trimethoxycinnamic acid (TMCA), NCGC00095563-01, NCGC00095563-02, 2-Propenoic acid,4,5-trimethoxyphenyl)-, AC-16693, AC-24565, AJ-12757, AN-42525, AS-11999, LS-54183, SC-07259, 3-(3,4,5-Trimethoxyphenyl)propenoic acid, AB1000948, BC2197781, Cinnamic acid, 3,4,5-trimethoxy-, (E)-, RT-002812, TR-030993, 3,4,5-Trimethoxycinnamic acid, pred. trans, 3-(3,4,5-trimethoxyphenyl)-2-propenoicaci, 3-(3,5-Trimethoxyphenyl)-2-propenoic acid, ST24032529, ST45027564, 3-(3,4,5-trimethoxyphenyl)-2-propenoicacid, (E)-3-(3,4,5-trimethoxyphenyl) acrylic acid, (e)-3-(3,4,5-trimethoxy-phenyl)-acrylic acid, 004T388, AS-871/13102032, SR-01000773278, SR-01000773278-2, BRD-K63758740-001-02-3, 2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, (E)-, 2-Propenoic acid,3-(3,4,5-trimethoxyphenyl)-, (2E)-, F3284-8534, 646E4CC1-F441-40D8-B1BB-87A43D1B3600, 3,4,5-Trimethoxycinnamic acid, analytical reference material, 9-Xanthenone, TMCA, 3,4,5-trimethoxykanelsyre, C12H14O5, trans-3,4,5-Trimethoxyzimtsaure, KST-1A8866, AR-1A2301, AR-1E8923, CID735755, 3,4,5-TRIMETHOXYCINNAMICACID, ACN-057286, C12-H14-O5, T1104, 3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid, trans-3-(3,4,5-Trimethoxyphenyl)-2-propensaure, 3,4,5-Trimethoxycinnamic acid, 99% - 100G 100g, 91403-61-1, 96575-24-5,

Complexity	262
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	238.084g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	238.239g/mol
Monoisotopic Mass	238.084g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	65A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H315
Packing Group	Ⅲ
Precautionary statements	P301+P310
Signal Words	danger
UN Code	UN 2810

Certificate of Analysis

Lot Number