1-PHENYL-HEPTANE-1,4-DIONE
1-PHENYL-HEPTANE-1,4-DIONE structure
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Common Name | 1-PHENYL-HEPTANE-1,4-DIONE | ||
|---|---|---|---|---|
| CAS Number | 63297-52-9 | Molecular Weight | 204.26500 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C13H16O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-phenylheptane-1,4-dione |
|---|---|
| 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.
| Molecular Formula | C13H16O2 |
|---|---|
| Molecular Weight | 204.26500 |
| Exact Mass | 204.11500 |
| PSA | 34.14000 |
| LogP | 3.01870 |
| InChIKey | AKIADVSHKRVDTG-UHFFFAOYSA-N |
| SMILES | CCCC(=O)CCC(=O)c1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2914399090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~82%
1-PHENYL-HEPTAN... CAS#:63297-52-9 |
| Literature: Stetter, Hermann; Jonas, Friedrich Chemische Berichte, 1981 , vol. 114, # 2 p. 564 - 580 |
|
~51%
1-PHENYL-HEPTAN... CAS#:63297-52-9 |
| Literature: Xue, Song; Li, Le-Zhen; Liu, Yong-Kang; Guo, Qing-Xiang Journal of Organic Chemistry, 2006 , vol. 71, # 1 p. 215 - 218 |
|
~%
1-PHENYL-HEPTAN... CAS#:63297-52-9 |
| Literature: Stetter,H. et al. Chemische Berichte, 1977 , vol. 110, p. 1971 - 1977 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914399090 |
|---|---|
| Summary | 2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-PHENYL-HEPTANE-1,4-DIONE |
| 1-Phenyl-1,4-heptandion |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 1-phenylheptane-1,4-dione? |
| A: SMILES notation of 1-phenylheptane-1,4-dione is CCCC(=O)CCC(=O)c1ccccc1. |
| Q: What is the molecular weight of 1-phenylheptane-1,4-dione? |
| A: Molecular weight of 1-phenylheptane-1,4-dione is 204.26500. |
| Q: What is the polar surface area (PSA) of 1-phenylheptane-1,4-dione? |
| A: Polar surface area (PSA) of 1-phenylheptane-1,4-dione is 34.14000. |
| Q: What is the CAS number of 1-phenylheptane-1,4-dione? |
| A: CAS number of 1-phenylheptane-1,4-dione is 63297-52-9. |
| Q: What is the LogP of 1-phenylheptane-1,4-dione? |
| A: LogP of 1-phenylheptane-1,4-dione is 3.01870. |
| Q: What is the InChIKey of 1-phenylheptane-1,4-dione? |
| A: InChIKey of 1-phenylheptane-1,4-dione is AKIADVSHKRVDTG-UHFFFAOYSA-N. |
| Q: What English synonyms does 1-phenylheptane-1,4-dione have? |
| A: English synonyms of 1-phenylheptane-1,4-dione: 1-PHENYL-HEPTANE-1,4-DIONE, 1-Phenyl-1,4-heptandion. |
| Q: What is the English name of 1-phenylheptane-1,4-dione? |
| A: The English name of 1-phenylheptane-1,4-dione is 1-phenylheptane-1,4-dione. |
| Q: What is the molecular formula of 1-phenylheptane-1,4-dione? |
| A: Molecular formula of 1-phenylheptane-1,4-dione is C13H16O2. |
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. |