Isoamyl Benzoate
Isoamyl Benzoate structure
|
Common Name | Isoamyl Benzoate | ||
|---|---|---|---|---|
| CAS Number | 94-46-2 | Molecular Weight | 192.25400 | |
| Density | 0.99 g/mL at 25 °C(lit.) | Boiling Point | 261-262 °C(lit.) | |
| Molecular Formula | C12H16O2 | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | >230 °F | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Isoamyl Benzoate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.99 g/mL at 25 °C(lit.) |
|---|---|
| Boiling Point | 261-262 °C(lit.) |
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.25400 |
| Flash Point | >230 °F |
| Exact Mass | 192.11500 |
| PSA | 26.30000 |
| LogP | 2.88950 |
| Index of Refraction | n20/D 1.494(lit.) |
| InChIKey | MLLAPOCBLWUFAP-UHFFFAOYSA-N |
| SMILES | CC(C)CCOC(=O)c1ccccc1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Personal Protective Equipment | Eyeshields;Gloves |
|---|---|
| Safety Phrases | S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 2 |
| RTECS | DH3078000 |
| HS Code | 2916310090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916310090 |
|---|---|
| Summary | 2916310090 other benzoic acid and its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 202-334-4 |
| MFCD00026515 |
| 3-methylbutyl benzoate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of Isoamyl Benzoate? |
| A: Molecular weight of Isoamyl Benzoate is 192.25400. |
| Q: What is the molecular formula of Isoamyl Benzoate? |
| A: Molecular formula of Isoamyl Benzoate is C12H16O2. |
| Q: What is the SMILES notation of Isoamyl Benzoate? |
| A: SMILES notation of Isoamyl Benzoate is CC(C)CCOC(=O)c1ccccc1. |
| Q: What is the safety information for Isoamyl Benzoate? |
| A: Safety information for Isoamyl Benzoate: S24/25. |
| Q: What is the polar surface area (PSA) of Isoamyl Benzoate? |
| A: Polar surface area (PSA) of Isoamyl Benzoate is 26.30000. |
| Q: What is the InChIKey of Isoamyl Benzoate? |
| A: InChIKey of Isoamyl Benzoate is MLLAPOCBLWUFAP-UHFFFAOYSA-N. |
| Q: What is the boiling point of Isoamyl Benzoate? |
| A: Boiling point of Isoamyl Benzoate is 261-262 °C(lit.). |
| Q: What is the CAS number of Isoamyl Benzoate? |
| A: CAS number of Isoamyl Benzoate is 94-46-2. |
| Q: What English synonyms does Isoamyl Benzoate have? |
| A: English synonyms of Isoamyl Benzoate: EINECS 202-334-4, MFCD00026515, 3-methylbutyl benzoate. |
| Q: What is the LogP of Isoamyl Benzoate? |
| A: LogP of Isoamyl Benzoate is 2.88950. |
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. |