3-tert-butylcyclohexan-1-one
3-tert-butylcyclohexan-1-one structure
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Common Name | 3-tert-butylcyclohexan-1-one | ||
|---|---|---|---|---|
| CAS Number | 936-99-2 | Molecular Weight | 154.24900 | |
| Density | 0.911g/cm3 | Boiling Point | 213.3ºC at 760 mmHg | |
| Molecular Formula | C10H18O | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 75.7ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-tert-butylcyclohexan-1-one |
|---|---|
| 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 | 0.911g/cm3 |
|---|---|
| Boiling Point | 213.3ºC at 760 mmHg |
| Molecular Formula | C10H18O |
| Molecular Weight | 154.24900 |
| Flash Point | 75.7ºC |
| Exact Mass | 154.13600 |
| PSA | 17.07000 |
| LogP | 2.79180 |
| Index of Refraction | 1.456 |
| InChIKey | YJZOKOQSQKNYLW-UHFFFAOYSA-N |
| SMILES | CC(C)(C)C1CCCC(=O)C1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2914299000 |
|---|
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 2 | |
CAS#:930-68-7
CAS#:594-19-4
CAS#:507-19-7
CAS#:585-34-2
CAS#:3178-22-1
CAS#:558-17-8
CAS#:56583-96-1
CAS#:677-22-5
CAS#:3419-66-7
CAS#:17299-35-3This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914299000 |
|---|---|
| Summary | 2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-tert-Butylcyclohexanone |
| 3-tert-Butyl-cyclohexanon |
| Cyclohexanone,3-tert-butyl |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 3-tert-butylcyclohexan-1-one? |
| A: InChIKey of 3-tert-butylcyclohexan-1-one is YJZOKOQSQKNYLW-UHFFFAOYSA-N. |
| Q: What is the LogP of 3-tert-butylcyclohexan-1-one? |
| A: LogP of 3-tert-butylcyclohexan-1-one is 2.79180. |
| Q: What is the molecular formula of 3-tert-butylcyclohexan-1-one? |
| A: Molecular formula of 3-tert-butylcyclohexan-1-one is C10H18O. |
| Q: What is the English name of 3-tert-butylcyclohexan-1-one? |
| A: The English name of 3-tert-butylcyclohexan-1-one is 3-tert-butylcyclohexan-1-one. |
| Q: What are the upstream materials of 3-tert-butylcyclohexan-1-one? |
| A: Related upstream materials(CAS) of 3-tert-butylcyclohexan-1-one: 930-68-7;594-19-4;507-19-7;585-34-2;3178-22-1;558-17-8;56583-96-1;677-22-5. |
| Q: What are the downstream products of 3-tert-butylcyclohexan-1-one? |
| A: Related downstream products(CAS) of 3-tert-butylcyclohexan-1-one: 3419-66-7;17299-35-3. |
| Q: What is the boiling point of 3-tert-butylcyclohexan-1-one? |
| A: Boiling point of 3-tert-butylcyclohexan-1-one is 213.3ºC at 760 mmHg. |
| Q: What is the molecular weight of 3-tert-butylcyclohexan-1-one? |
| A: Molecular weight of 3-tert-butylcyclohexan-1-one is 154.24900. |
| Q: What English synonyms does 3-tert-butylcyclohexan-1-one have? |
| A: English synonyms of 3-tert-butylcyclohexan-1-one: 3-tert-Butylcyclohexanone, 3-tert-Butyl-cyclohexanon, Cyclohexanone,3-tert-butyl. |
| Q: What is the polar surface area (PSA) of 3-tert-butylcyclohexan-1-one? |
| A: Polar surface area (PSA) of 3-tert-butylcyclohexan-1-one is 17.07000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |