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2,3-Dimethoxybenzoic Acid
[CAS# 153898-63-6]

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Identification
Name 2,3-Dimethoxybenzoic Acid
Synonyms "2,3-Dimethoxybenzoic acid "; "2,3-Dimethoxybenzoic acid"; (3-chlorophenyl)acetonitrile
Molecular Structure CAS#: 153898-63-6, 2,3-Dimethoxybenzoic Acid
Molecular Formula C9H10O4
Molecular Weight 182.17
CAS Registry Number 153898-63-6
SMILES COC1=CC=CC(=C1OC)C(=O)O
InChI 1S/C9H10O4/c1-12-7-5-3-4-6(9(10)11)8(7)13-2/h3-5H,1-2H3,(H,10,11)
InChIKey FODBVCSYJKNBLO-UHFFFAOYSA-N
Properties
Density 1.2±0.1g/cm3 (Cal.)
Melting point 124°C (Expl.)
Boiling point 304.4±22.0°C at 760 mmHg (Cal.)
Flash point 121.6±15.8°C (Cal.)
Refractive index 1.533 (Cal.)
Safety Data
Safety Code S26;S37  Details
Risk Code R36/37/38  Details
Hazard Symbol symbol  X  Details
Safety Description IRRITANT
WARNING: Irritates lungs, eyes, skin
References
(1) Rupali Shivapurkar and Damien Jeannerat. Determination of the relative pK's of mixtures of organic acids using NMR titration experiments based on aliased H–C HSQC spectra, Anal. Methods, 2011, 3, 1316.
Market Analysis Reports
List of Reports Available for 2,3-Dimethoxybenzoic Acid
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