4-(tert-Butyl)cyclohexanol
4-(tert-Butyl)cyclohexanol structure
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Common Name | 4-(tert-Butyl)cyclohexanol | ||
|---|---|---|---|---|
| CAS Number | 98-52-2 | Molecular Weight | 156.265 | |
| Density | 0.9±0.1 g/cm3 | Boiling Point | 214.2±0.0 °C at 760 mmHg | |
| Molecular Formula | C10H20O | Melting Point | 62-70 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 105.0±0.0 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Tert-Butylcyclohexanol |
|---|---|
| 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 | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 214.2±0.0 °C at 760 mmHg |
| Melting Point | 62-70 °C(lit.) |
| Molecular Formula | C10H20O |
| Molecular Weight | 156.265 |
| Flash Point | 105.0±0.0 °C |
| Exact Mass | 156.151413 |
| PSA | 20.23000 |
| LogP | 3.06 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.471 |
| InChIKey | CCOQPGVQAWPUPE-UHFFFAOYSA-N |
| SMILES | CC(C)(C)C1CCC(O)CC1 |
| Water Solubility | <1 g/L (20 ºC) |
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;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Hazard Codes | Xn |
| Safety Phrases | S24/25 |
| RIDADR | 3256 |
| WGK Germany | 1 |
| RTECS | GV8750000 |
| HS Code | 2906199090 |
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 9 | |
|---|---|
| DownStream 8 | |
CAS#:98-54-4
CAS#:80356-16-7
CAS#:98-53-3
CAS#:677-22-5
CAS#:74052-93-0
CAS#:68039-42-9
CAS#:693-03-8
CAS#:111-90-0
CAS#:21862-63-5
CAS#:3178-22-1
CAS#:937-05-3
CAS#:943-29-3
CAS#:42125-46-2
CAS#:4114-28-7
CAS#:38946-63-3This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2906199090 |
|---|---|
| Summary | 2906199090. cyclanic, cyclenic or cyclotherpenic alcohols. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Acylation of Chiral Alcohols: A Simple Procedure for Chiral GC Analysis.
J. Anal. Methods Chem. 2012 , 452949, (2012) The use of iodine as a catalyst and either acetic or trifluoroacetic acid as a derivatizing reagent for determining the enantiomeric composition of acyclic and cyclic aliphatic chiral alcohols was inv... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| p-tert-Butylcyclohexanol |
| 4-(2-Methyl-2-propanyl)cyclohexanol |
| L6TJ AX1&1&1 DQ |
| 4-tert-Butylcyclohexanol |
| MFCD00001473 |
| 4-(1,1-Dimethylethyl)cyclohexanol |
| EINECS 202-676-4 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 4-Tert-Butylcyclohexanol? |
| A: LogP of 4-Tert-Butylcyclohexanol is 3.06. |
| Q: What are the upstream materials of 4-Tert-Butylcyclohexanol? |
| A: Related upstream materials(CAS) of 4-Tert-Butylcyclohexanol: 98-54-4;80356-16-7;98-53-3;677-22-5;74052-93-0;68039-42-9;693-03-8;111-90-0;21862-63-5. |
| Q: What is the safety information for 4-Tert-Butylcyclohexanol? |
| A: Safety information for 4-Tert-Butylcyclohexanol: S24/25. |
| Q: How is the water solubility of 4-Tert-Butylcyclohexanol? |
| A: Water solubility of 4-Tert-Butylcyclohexanol: <1 g/L (20 ºC). |
| Q: What is the CAS number of 4-Tert-Butylcyclohexanol? |
| A: CAS number of 4-Tert-Butylcyclohexanol is 98-52-2. |
| Q: What is the English name of 4-Tert-Butylcyclohexanol? |
| A: The English name of 4-Tert-Butylcyclohexanol is 4-Tert-Butylcyclohexanol. |
| Q: What is the molecular formula of 4-Tert-Butylcyclohexanol? |
| A: Molecular formula of 4-Tert-Butylcyclohexanol is C10H20O. |
| Q: What is the InChIKey of 4-Tert-Butylcyclohexanol? |
| A: InChIKey of 4-Tert-Butylcyclohexanol is CCOQPGVQAWPUPE-UHFFFAOYSA-N. |
| Q: What is the melting point of 4-Tert-Butylcyclohexanol? |
| A: Melting point of 4-Tert-Butylcyclohexanol is 62-70 °C(lit.). |
| Q: What are the downstream products of 4-Tert-Butylcyclohexanol? |
| A: Related downstream products(CAS) of 4-Tert-Butylcyclohexanol: 3178-22-1;937-05-3;943-29-3;42125-46-2;98-53-3;21862-63-5;4114-28-7;38946-63-3. |
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. |