4-tert-Butylcyclohexanone
- CAS No.
- 98-53-3
- Chemical Name:
- 4-tert-Butylcyclohexanone
- Synonyms
- 98-53-3;4-t-Butylcyclohexanone;4-tert-Butyl;4CO;c64;TBHK;c 64;YLANATKETON;AKOS BBS-00000687;TIMTEC-BB SBB007656
- CBNumber:
- CB4254201
- Molecular Formula:
- C10H18O
- Molecular Weight:
- 154.25
- MOL File:
- 98-53-3.mol
- MSDS File:
- SDS
- Modify Date:
- 2024/6/7 15:08:35
| Melting point | 47-50 °C (lit.) |
|---|---|
| Boiling point | 113-116 °C/20 mmHg (lit.) |
| Density | 0.893 |
| vapor pressure | 7.91-14.2Pa at 20-25℃ |
| refractive index | 1.4570 (estimate) |
| Flash point | 205 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly), Methanol (Slightly); Almost insoluble in water, soluble in alcohol and oils. |
| form | Crystalline Powder |
| color | White to almost white |
| Odor | Powerful, dry-camphoraceous, slightly minty odor with woody Cedar-Patchouli-like undertones. |
| Odor Type | woody |
| Water Solubility | Soluble in alcohol, ethanol (0.5g/10 mL). Insoluble in water. |
| BRN | 507309 |
| InChIKey | YKFKEYKJGVSEIX-UHFFFAOYSA-N |
| LogP | 2.91 |
| CAS DataBase Reference | 98-53-3(CAS DataBase Reference) |
| NIST Chemistry Reference | Cyclohexanone, 4-(1,1-dimethylethyl)-(98-53-3) |
| EPA Substance Registry System | Cyclohexanone, 4-(1,1-dimethylethyl)- (98-53-3) |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |  GHS07 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Warning | |||||||||
| Hazard statements | H302-H412 | |||||||||
| Precautionary statements | P273-P301+P312+P330 | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 26-36 | |||||||||
| WGK Germany | 2 | |||||||||
| RTECS | GW1140000 | |||||||||
| TSCA | Yes | |||||||||
| HS Code | 29142990 | |||||||||
| Toxicity | Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits were reported to be 5 g/kg | |||||||||
| NFPA 704 |
|
4-tert-Butylcyclohexanone price More Price(6)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich(India) | B92303 | 4-tert-Butylcyclohexanone 99% | 98-53-3 | 25G | ₹1948.5 | 2022-06-14 | Buy |
| Sigma-Aldrich(India) | B92303 | 4-tert-Butylcyclohexanone 99% | 98-53-3 | 100G | ₹3225.85 | 2022-06-14 | Buy |
| TCI Chemicals (India) | B1074 | 4-tert-Butylcyclohexanone min. 97.0 % | 98-53-3 | 25G | ₹3000 | 2022-05-26 | Buy |
| ALFA India | ALF-A15612-22 | 4-tert-Butylcyclohexanone, 99% | 98-53-3 | 100g | ₹4064 | 2022-05-26 | Buy |
| TCI Chemicals (India) | B1074 | 4-tert-Butylcyclohexanone min. 97.0 % | 98-53-3 | 100G | ₹9000 | 2022-05-26 | Buy |
4-tert-Butylcyclohexanone Chemical Properties,Uses,Production
Chemical Properties
WHITE TO ALMOST WHITE CRYSTALLINE POWDER
Occurrence
Has apparently not been reported to occur in nature.
Uses
4-tert-Butylcyclohexanone is used as a perfuming agents and in cosmetic. This material, commercially available for almost two decades, has only temporarily gained some importance as a powerful, “lifting” soap perfume ingredient, or as an in-expensive additive to Patchouli notes for soap and detergent fragrances, etc. It has more power and much less tenacity than Cedarwood and Patchouli, which is only an advantage in certain types of household products, where tenacity is not always very desirable. The title ketone can also give powerful “lift” to certain types of floral fragrance and to most of the herbaceous ones, Lavender, Lavandin, Rosemary, etc.
Preparation
By hydrogenation of p-ferr-butylphenol. Care must be taken that no free p-tert-butylphenol remains, because it is a sensitizer and depigmenting agent(Opdyke, 1974).
Purification Methods
Purify it via the semicarbazone (crystallised from EtOH with m 203-205o), hydrolyse this with dilute HCl and steam distil it. The distillate is extracted into Et2O, dried, evaporated and the residue is recrystallised from pentane, aqueous EtOH or EtOH [Houlihan J Org Chem 27 3860 1962]. The oxime recrystallises from 1,2-dichloropropane and has m 137.5-138.5o. [Harvill et al. J Org Chem 15 58 1950, Beilstein 7 IV 82.]
4-tert-Butylcyclohexanone Preparation Products And Raw materials
Raw materials
1of3
chevron_rightPreparation Products
| Supplier | Tel | Country | ProdList | Advantage | Inquiry |
|---|---|---|---|---|---|
| LANXESS India Pvt. Ltd. | +91-8356878763 +91-8356878763 | Maharashtra, India | 190 | 58 | Inquiry |
| JSK Chemicals | +919879767970 | Gujarat, India | 3756 | 58 | Inquiry |
| Unisource Chemicals Private Limited | 08048372772Ext 301 | Maharashtra, India | 290 | 58 | Inquiry |
| Anand Agencies | 91-20-24454597 | Maharashtra, India | 2337 | 58 | Inquiry |
| S H Kelkar and Company Limited | 91-22-22069609 | Maharashtra, India | 62 | 58 | Inquiry |
| Mapin Industrial Company | 91-22-28380579 | Maharashtra, India | 77 | 58 | Inquiry |
| Libra Chemical Exports Company | +91 22 289 16 901 | Mumbai, India | 45 | 58 | Inquiry |
| LANXESS India Pvt. Ltd. | +91-22-2587 1000 | Maharashtra, India | 131 | 58 | Inquiry |
| K.V. Arochem Limited | +91 22 22069609 | Mumbai, India | 53 | 58 | Inquiry |
| SPIC Pharma | +91 44 22350278 | Tamil Nadu, India | 4 | 58 | Inquiry |
| Supplier | Advantage |
|---|---|
| LANXESS India Pvt. Ltd. | 58 |
| JSK Chemicals | 58 |
| Unisource Chemicals Private Limited | 58 |
| Anand Agencies | 58 |
| S H Kelkar and Company Limited | 58 |
| Mapin Industrial Company | 58 |
| Libra Chemical Exports Company | 58 |
| LANXESS India Pvt. Ltd. | 58 |
| K.V. Arochem Limited | 58 |
| SPIC Pharma | 58 |
98-53-3(4-tert-Butylcyclohexanone)Related Search:
1of4
chevron_right