octyl benzoate
octyl benzoate structure
|
Common Name | octyl benzoate | ||
|---|---|---|---|---|
| CAS Number | 94-50-8 | Molecular Weight | 234.33400 | |
| Density | 0.964g/cm3 | Boiling Point | 320.7ºC at 760 mmHg | |
| Molecular Formula | C15H22O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 135.2ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | octyl 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 | 0.964g/cm3 |
|---|---|
| Boiling Point | 320.7ºC at 760 mmHg |
| Molecular Formula | C15H22O2 |
| Molecular Weight | 234.33400 |
| Flash Point | 135.2ºC |
| Exact Mass | 234.16200 |
| PSA | 26.30000 |
| LogP | 4.20390 |
| Index of Refraction | 1.491 |
| InChIKey | VECVSKFWRQYTAL-UHFFFAOYSA-N |
| SMILES | CCCCCCCCOC(=O)c1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2916310090 |
|---|
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 10 | |
|---|---|
| DownStream 2 | |
CAS#:111-87-5
CAS#:93-97-0
CAS#:100-51-6
CAS#:2902-69-4
CAS#:98-88-4
CAS#:65-85-0
CAS#:629-82-3
CAS#:455-32-3
CAS#:789-25-3
CAS#:94-36-0This 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 contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Minimum fungicidal concentration against Saccharomyces cerevisiae(no antifungal activ...
Source: ChEMBL
Target: Saccharomyces cerevisiae
External Id: CHEMBL808229
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Benzoesaeure-octylester |
| Benzoesaeure-n-octylester |
| n-Octyl benzoate |
| Benzoic acid octyl ester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of octyl benzoate? |
| A: CAS number of octyl benzoate is 94-50-8. |
| Q: What are the downstream products of octyl benzoate? |
| A: Related downstream products(CAS) of octyl benzoate: 111-87-5;65-85-0. |
| Q: What is the SMILES notation of octyl benzoate? |
| A: SMILES notation of octyl benzoate is CCCCCCCCOC(=O)c1ccccc1. |
| Q: What is the InChIKey of octyl benzoate? |
| A: InChIKey of octyl benzoate is VECVSKFWRQYTAL-UHFFFAOYSA-N. |
| Q: What English synonyms does octyl benzoate have? |
| A: English synonyms of octyl benzoate: Benzoesaeure-octylester, Benzoesaeure-n-octylester, n-Octyl benzoate, Benzoic acid octyl ester. |
| Q: What is the molecular formula of octyl benzoate? |
| A: Molecular formula of octyl benzoate is C15H22O2. |
| Q: What is the English name of octyl benzoate? |
| A: The English name of octyl benzoate is octyl benzoate. |
| Q: What is the molecular weight of octyl benzoate? |
| A: Molecular weight of octyl benzoate is 234.33400. |
| Q: What is the boiling point of octyl benzoate? |
| A: Boiling point of octyl benzoate is 320.7ºC at 760 mmHg. |
| Q: What is the polar surface area (PSA) of octyl benzoate? |
| A: Polar surface area (PSA) of octyl benzoate is 26.30000. |
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. |