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Substance Name: Veratric acid
RN: 93-07-2
UNII: 1YY04E7RR4
InChIKey: DAUAQNGYDSHRET-UHFFFAOYSA-N
Classification Code
- Mutation Data
Molecular Formula
- C9-H10-O4
Molecular Weight
- 182.174
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- Veratric acid
Synonyms
- 3,4-Dimethoxybenzoic acid
- 3,4-Dimethylprotocatechuic acid
- 4-10-00-01460 (Beilstein Handbook Reference)
- BRN 0518285
- Dimethylprotocatechuic acid
- EC 202-215-7
- EINECS 202-215-7
- NSC 7721
- UNII-1YY04E7RR4
- Veratric acid
Systematic Names
- 3,4-Dimethoxybenzoic acid
- Benzoic acid, 3,4-dimethoxy-
- Veratric acid
Registry Numbers
CAS Registry Number
- 93-07-2
FDA UNII
- 1YY04E7RR4
System Generated Number
- 0000093072
Structure Descriptors
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)InChIKey
DAUAQNGYDSHRET-UHFFFAOYSA-NSmiles
COc1ccc(cc1OC)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | > 800mg/kg (800mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 196, Pg. 478, 1976. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 181 | deg C | EXP | |
| pKa Dissociation Constant | 4.36 | (none) | 25 | EXP |
| log P (octanol-water) | 1.61 | (none) | EXP | |
| Water Solubility | 500 | mg/L | 14 | EXP |
| Henry's Law Constant | 3.79E-10 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 9.07E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.