CAS 645-08-9|Isovanillic acid
| Common Name | Isovanillic acid | ||
|---|---|---|---|
| CAS Number | 645-08-9 | Molecular Weight | 168.147 |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 344.3±27.0 °C at 760 mmHg |
| Molecular Formula | C8H8O4 | Melting Point | 250-253 °C(lit.) |
| MSDS | ChineseUSA | Flash Point | 145.2±17.2 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | 3-hydroxy-4-methoxybenzoic acid |
|---|---|
| Synonym | More Synonyms |
Isovanillic acid BiologicalActivity
| Description | Isovanillic acid (3-Hydroxy-4-methoxybenzoic acid) is a phenolic acid isolated from isolated from S. frutescens, with Anti-inflammatory activity[1]. |
|---|---|
| Related Catalog | Signaling Pathways >>Others >>OthersResearch Areas >>Inflammation/Immunology |
| References | [1]. Fernández MA, et al. Anti-inflammatory activity in rats and mice of phenolic acids isolated from Scrophularia frutescens. J Pharm Pharmacol. 1998 Oct;50(10):1183-6. |
Chemical & Physical Properties
| Density | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 344.3±27.0 °C at 760 mmHg |
| Melting Point | 250-253 °C(lit.) |
| Molecular Formula | C8H8O4 |
| Molecular Weight | 168.147 |
| Flash Point | 145.2±17.2 °C |
| Exact Mass | 168.042252 |
| PSA | 66.76000 |
| LogP | 1.35 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.586 |
| InChIKey | LBKFGYZQBSGRHY-UHFFFAOYSA-N |
| SMILES | COc1ccc(C(=O)O)cc1O |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 2974 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- COREAF Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. (Paris, France) V.1-261, 1835-1965. For publisher information, see CRASEV. Volume(issue)/page/year: 243,609,1956
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36-S37/39 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | BZ4850000 |
| HS Code | 2918990090 |
Customs
| HS Code | 2918990090 |
|---|---|
| Summary | 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| Isovanillic acid |
| Benzoic acid, 3-hydroxy-4-methoxy- |
| MFCD00002507 |
| p-Anisic acid,3-hydroxy |
| 3-hydroxy-4-methoxy-benzoic acid |
| isovanilinic acid |
| 3-Hydroxyanisic acid |
| EINECS 211-430-5 |
| 4-methoxy-protocatechuic acid |
| 3-Hydroxy-4-methoxybenzoic acid |
| Acide isovanillique |
| 3-hydroxy-4-methoxybenzoate |
| 3-Hydroxy-p-anisic acid |
