AG0033IP

93-07-2 | 3,4-Dimethoxybenzoic Acid

AG0033IP

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CAS Number	93-07-2
Catalog Number	AG0033IP(AGN-PC-0C1EA1)
Chemical Name	3,4-Dimethoxybenzoic Acid
EC Number	202-215-7
IUPAC Name	3,4-dimethoxybenzoic acid
InChI	InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)
InChI Key	DAUAQNGYDSHRET-UHFFFAOYSA-N
MDL Number	MFCD00002500
Molecular Formula	C9H10O4
Molecular Weight	182.1733
NSC Number	7721
SMILES	O=C(O)c1ccc(OC)c(OC)c1
UNII	1YY04E7RR4
Synonyms	veratric acid, veratric acid, potassium salt, veratric acid, sodium salt, veratric acid, sodium salt, (11)C-labeled, 3,4-Dimethoxybenzoic acid, VERATRIC ACID, 93-07-2, Benzoic acid, 3,4-dimethoxy-, Dimethylprotocatechuic acid, Veratrumenoic acid, Veratrylic acid, 3,4-Dimethylprotocatechuic acid, 3,4-Dimethoxy-benzoic acid, NSC 7721, UNII-1YY04E7RR4, MFCD00002500, CHEBI:296881, EINECS 202-215-7, BRN 0518285, 3,4-Dimethoxybenzoic acid (Veratric acid), 1YY04E7RR4, CHEMBL118903, DAUAQNGYDSHRET-UHFFFAOYSA-N, 3,4-Dimethoxybenzoic acid, 99+%, 3,4-dimethoxybenzoes, veratric-acid, PubChem13788, Spectrum_000512, AC1Q4FEP, Spectrum2_001082, Spectrum3_001774, Spectrum4_001582, Spectrum5_000264, 3,4 dimethoxybenzoic acid, 3,4-dimethoxybenzoic-acid, 3,4dimethoxy benzoic acid, bmse010207, Epitope ID:119695, EC 202-215-7, AC1Q46MI, 3,4-Dimethoxy benzoic acid, ACMC-1CA67, BSPBio_003267, KBioGR_002164, KBioSS_000992, SPECTRUM212140, KSC489M8H, MLS002207141, SCHEMBL114848, SPBio_001124, AC1L1O21, 3,4-bis(methyloxy)benzoic acid, DTXSID6059077, CTK3I9683, KBio2_000992, KBio2_003560, KBio2_006128, KBio3_002768, NSC7721, Protocatechuic Acid Dimethyl Ether, ZINC392017, HY-N2007, NSC-7721, ANW-13645, BBL025942, BDBM50336487, CCG-39276, CD0096, SBB040520, STK397279, 3,4-Dimethoxybenzoic acid, >=99%, AKOS000119433, BS-3989, MCULE-2108800864, RP24315, RTR-038447, SDCCGMLS-0066972.P001, TRA0004863, NCGC00095539-01, NCGC00095539-02, 3,4-Dimethoxybenzoic acid; Veratric acid, AC-10246, AJ-21207, AK-45550, AN-24252, LS-37122, SMR000112092, AB1002355, ST2410268, TL8000030, TR-038447, CS-0018327, D0631, FT-0648222, ST45103469, T8296, AZ0001-0140, SR-05000002417, I01-0178, SR-05000002417-1, W-100257, BRD-K14520048-001-02-6, BRD-K14520048-001-04-2, F2191-0107, Z235345619, InChI=1/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11, TWO, veratrumsyre-, 3,4-Dimethoxybenzoicacid, Benzoic acid,4-dimethoxy-, Acide dimethoxy-3,4-benzoique, C9H10O4, CID7121, AR-1E9236, C9-H10-O4, 3,4-Dimethoxy[7-13C]-benzoic Acid, ACN-056794, CS-T-46379, 4-10-00-01460 (Beilstein Handbook Reference), 3,4-Dimethoxybenzoic acid, 99% - 100G 100g, 90140-57-1,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.058g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	182.175g/mol
Monoisotopic Mass	182.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number