AG0037K6

5722-93-0 | 2-Hydroxy-4,5-Dimethoxy Benzoic Acid

AG0037K6

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CAS Number	5722-93-0
Catalog Number	AG0037K6(AGN-PC-00BOQJ)
Chemical Name	2-Hydroxy-4,5-Dimethoxy Benzoic Acid
IUPAC Name	2-hydroxy-4,5-dimethoxybenzoic acid
InChI	InChI=1S/C9H10O5/c1-13-7-3-5(9(11)12)6(10)4-8(7)14-2/h3-4,10H,1-2H3,(H,11,12)
InChI Key	RUBXSZYVSFYJQR-UHFFFAOYSA-N
MDL Number	MFCD19441387
Molecular Formula	C9H10O5
Molecular Weight	198.1727
SMILES	COc1cc(C(=O)O)c(cc1OC)O
Synonyms	2-HYDROXY-4,5-DIMETHOXYBENZOIC ACID, 5722-93-0, 2-Hydroxy-4,5-Dimethoxy Benzoic Acid, Benzoic acid, 2-hydroxy-4,5-dimethoxy-, KSC496I7F, SCHEMBL1038769, CTK3J6472, KS-00000QGQ, DTXSID00468661, RUBXSZYVSFYJQR-UHFFFAOYSA-N, 8404AB, ANW-65810, MFCD19441387, ZINC13541475, AKOS016005438, AJ-64105, AK-87536, DS-18342, SY113018, DB-024439, RT-003038, FT-0754708, ST24040673, MFCD19441387 (95%), Veratric acid, 6-hydroxy-, C9H10O5, 2-HYDROXY-4,5-DIMETHOXYBENZOICACID, 2-hydroxy-4,5-dimethoxy-benzoic Acid, ACN-050260, CID11564650,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.053g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	198.174g/mol
Monoisotopic Mass	198.053g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	76A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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