2,4,5-trimethoxybenzoic acid
2,4,5-trimethoxybenzoic acid structure
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Common Name | 2,4,5-trimethoxybenzoic acid | ||
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| CAS Number | 490-64-2 | Molecular Weight | 212.199 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 300.0±0.0 °C at 760 mmHg | |
| Molecular Formula | C10H12O5 | Melting Point | 143-145 °C(lit.) | |
| MSDS | USA | Flash Point | 134.0±20.0 °C | |
Use of 2,4,5-trimethoxybenzoic acid2,4,5-Trimethoxybenzoic acid is a compound identified in purple perilla extracts. 2,4,5-Trimethoxybenzoic acid inhibits M1 macrophage phenotype-mediated inflammation in diabetes[1]. |
Summary: 2,4,5-Trimethoxybenzoic acid, also known as 2,4,5-三甲氧基苯甲酸, CAS号490-64-2, has a molecular formula of C10H12O5 and a molecular weight of 212.199. This compound is a white fine crystalline powder with a melting point of 143-145 °C and a boiling point of 300.0±0.0 °C, with a density of 1.2±0.1 g/cm3. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,4,5-Trimethoxybenzoic acid |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | 2,4,5-Trimethoxybenzoic acid is a compound identified in purple perilla extracts. 2,4,5-Trimethoxybenzoic acid inhibits M1 macrophage phenotype-mediated inflammation in diabetes[1]. |
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| Related Catalog | |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 300.0±0.0 °C at 760 mmHg |
| Melting Point | 143-145 °C(lit.) |
| Molecular Formula | C10H12O5 |
| Molecular Weight | 212.199 |
| Flash Point | 134.0±20.0 °C |
| Exact Mass | 212.068466 |
| PSA | 64.99000 |
| LogP | 1.52 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.524 |
| InChIKey | KVZUCOGWKYOPID-UHFFFAOYSA-N |
| SMILES | COc1cc(OC)c(C(=O)O)cc1OC |
| Water Solubility | SOLUBLE |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Hazard Codes | Xi |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2918990090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 10 | |
CAS#:4460-86-0
CAS#:30038-31-4
CAS#:38445-02-2
CAS#:3166-78-7
CAS#:5722-93-0
CAS#:77-78-1
CAS#:4463-16-5
CAS#:79105-52-5
CAS#:610-90-2
CAS#:135-77-3
CAS#:124-38-9
CAS#:3542-74-3
CAS#:3542-72-1
CAS#:20129-11-7
CAS#:1702-67-6
CAS#:1818-28-6
CAS#:14227-14-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| 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% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Quantitative phosphorus-31 NMR analysis of lignins, a new tool for the lignin chemist. Argyropoulos DS.
J. Wood Chem. Technol. 14(1) , 45-63, (1994)
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A new synthesis of asaronic acid and aldehyde and their derivatives. Rajagopalan S, et al.
Proc. Indian Acad. Sci. A 30(5) , 265-270, (1949)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Benzoic acid,2,4,5-trimethoxy |
| EINECS 207-715-9 |
| 2,4,5-Trimethoxy-benzoesaeure |
| 2,3-DIHYDRO-3-OXO-1H-INDENE-5-CARBONITRILE |
| 2,4,5-trimethoxy-benzoicaci |
| 2,4,5-Trimethoxybenzoic |
| RARECHEM AL BO 0322 |
| ASARONIC ACID |
| Asaronsaeure |
| MFCD00002435 |
| 2,4,5-trimethoxybenzoic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of 2,4,5-Trimethoxybenzoic acid? |
| A: Boiling point of 2,4,5-Trimethoxybenzoic acid is 300.0±0.0 °C at 760 mmHg. |
| Q: What is the melting point of 2,4,5-Trimethoxybenzoic acid? |
| A: Melting point of 2,4,5-Trimethoxybenzoic acid is 143-145 °C(lit.). |
| Q: What is the CAS number of 2,4,5-Trimethoxybenzoic acid? |
| A: CAS number of 2,4,5-Trimethoxybenzoic acid is 490-64-2. |
| Q: How is the water solubility of 2,4,5-Trimethoxybenzoic acid? |
| A: Water solubility of 2,4,5-Trimethoxybenzoic acid: SOLUBLE. |
| Q: What is the English name of 2,4,5-Trimethoxybenzoic acid? |
| A: The English name of 2,4,5-Trimethoxybenzoic acid is 2,4,5-Trimethoxybenzoic acid. |
| Q: What are the downstream products of 2,4,5-Trimethoxybenzoic acid? |
| A: Related downstream products(CAS) of 2,4,5-Trimethoxybenzoic acid: 30038-31-4;610-90-2;135-77-3;124-38-9;3542-74-3;3542-72-1;20129-11-7;1702-67-6;1818-28-6;14227-14-6. |
| Q: What is the SMILES notation of 2,4,5-Trimethoxybenzoic acid? |
| A: SMILES notation of 2,4,5-Trimethoxybenzoic acid is COc1cc(OC)c(C(=O)O)cc1OC. |
| Q: What is the molecular weight of 2,4,5-Trimethoxybenzoic acid? |
| A: Molecular weight of 2,4,5-Trimethoxybenzoic acid is 212.199. |
| Q: What is the molecular formula of 2,4,5-Trimethoxybenzoic acid? |
| A: Molecular formula of 2,4,5-Trimethoxybenzoic acid is C10H12O5. |
| Q: What are the upstream materials of 2,4,5-Trimethoxybenzoic acid? |
| A: Related upstream materials(CAS) of 2,4,5-Trimethoxybenzoic acid: 4460-86-0;30038-31-4;38445-02-2;3166-78-7;5722-93-0;77-78-1;4463-16-5;79105-52-5. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |