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Cas Database |
| Name |
2-(1-METHYLPROPYL)CYCLOHEXANONE |
EINECS | N/A |
| CAS No. | 14765-30-1 | Density | 0.912 g/mL at 25 °C(lit.) |
| PSA | 17.07000 | LogP | 2.79180 |
| Solubility | 577mg/L at 20℃ | Melting Point |
27.18°C (estimate) |
| Formula | C10H18 O | Boiling Point | 76-78 °C8 mm Hg(lit.) |
| Molecular Weight | 154.252 | Flash Point | 181 °F |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion. Low toxicity by skin contact. When heated to decomposition it emits acrid smoke and irritating vapors. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Cyclohexanone,2-sec-butyl- (7CI,8CI); 2-(1-Methylpropyl)cyclohexanone;2-sec-Butylcyclohexanone; Freskomenthe; NSC 21146 |
Article Data | 15 |
2-(1-METHYLPROPYL)CYCLOHEXANONE Synthetic route
| Conditions | Yield |
|---|---|
| With N-benzylbenzenesulfonamide; mesitylcopper(I) In toluene at 0℃; for 6h; | 90% |
- 34006-70-7
2,6-dibromocyclohexanone
- 14765-30-1
2-sec-butylcyclohexanone
| Conditions | Yield |
|---|---|
| In tetrahydrofuran at -78℃; |
- 91055-78-6
2-(1-methylpropylidene)cyclohexanone
- 14765-30-1
2-sec-butylcyclohexanone
| Conditions | Yield |
|---|---|
| With hydrogen; palladium |
- 590-18-1
(Z)-2-Butene
- 21300-30-1
lithium 1-cyclohexenolate
A
- 14765-30-1
2-sec-butylcyclohexanone
B
- 71501-12-7
2,6-di(sec-butyl)cyclohexanone
| Conditions | Yield |
|---|---|
| Yield given. Multistep reaction. Yields of byproduct given; |
- 624-64-6
trans-2-Butene
- 21300-30-1
lithium 1-cyclohexenolate
A
- 14765-30-1
2-sec-butylcyclohexanone
B
- 71501-12-7
2,6-di(sec-butyl)cyclohexanone
| Conditions | Yield |
|---|---|
| Yield given. Multistep reaction. Yields of byproduct given; |
- 7417-55-2
(E)-2-ethylidenecyclohexan-1-one
A
- 14765-30-1
2-sec-butylcyclohexanone
| Conditions | Yield |
|---|---|
| N-benzylbenzenesulfonamide; mesitylcopper(I) In toluene at 0℃; for 6h; Addition; | A 90 % Chromat. B n/a |
- 23029-03-0
1-acetoxy-6-bromo-cyclohexene
- 14765-30-1
2-sec-butylcyclohexanone
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: Zn / tetrahydrofuran 2: H2 / Pd View Scheme |
| Conditions | Yield |
|---|---|
| With toluene-4-sulfonic acid In propan-1-ol for 2h; Reflux; | 100% |
- 14765-30-1
2-sec-butylcyclohexanone
- 62-53-3
aniline
- 1100691-75-5
(-)-N-(phenyl)-[2-sec-butylcyclohexyl]amine
| Conditions | Yield |
|---|---|
| Stage #1: 2-sec-butylcyclohexanone; aniline With [(R)-BINAP]PdBr2 In chloroform for 0.166667h; Inert atmosphere; Stage #2: With hydrogen In chloroform at 70℃; under 41372.9 Torr; for 24h; enantioselective reaction; | 80% |
| Conditions | Yield |
|---|---|
| With iodine at 80℃; for 24h; Sealed tube; | 56% |
2-(1-METHYLPROPYL)CYCLOHEXANONE Chemical Properties
Systematic (IUPAC) name: 2-(1-METHYLPROPYL)CYCLOHEXANONE
Synonyms: 2-(1-methylpropyl)-cyclohexanon ; 2-sec-butyl-cyclohexanon ; FRESKOMENTHE ; FEMA 3261 ; 2-SEC-BUTYLCYCLOHEXANONE
Empirical Formula: C10H18O
Molecular Weight: 154.28g/mol
Index of Refraction: 1.452
Molar Volume: 171.5 cm3
Surface Tension: 30.1 dyne/cm
Flash Point: 75.8 °C
Boiling Point: 213.5 °C at 760 mmHg
Polar Surface Area: 17.07 ?2
Molar Refractivity: 46.29 cm3
Polarizability: 18.35 10-24cm3
Density: 0.899 g/cm3
Enthalpy of Vaporization: 44.98 kJ/mol
Vapour Pressure: 0.163 mmHg at 25°C
Structure of 2-(1-METHYLPROPYL)CYCLOHEXANONE (CAS NO. 14765-30-1)
Product Category of ketones.
2-(1-METHYLPROPYL)CYCLOHEXANONE Uses
Used to manufacture medicine.
2-(1-METHYLPROPYL)CYCLOHEXANONE Toxicity Data With Reference
| 1. | orl-rat LD50:2400 mg/kg | FCTOD7 Food and Chemical Toxicology. 30 (1992),11S. | ||
| 2. | skn-rbt LD50:>5 g/kg | FCTOD7 Food and Chemical Toxicology. 30 (1992),11S. |
2-(1-METHYLPROPYL)CYCLOHEXANONE Consensus Reports
Reported in EPA TSCA Inventory.
2-(1-METHYLPROPYL)CYCLOHEXANONE Safety Profile
Moderately toxic by ingestion. Low toxicity by skin contact. When heated to decomposition it emits acrid smoke and irritating vapors.
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
2-(1-METHYLPROPYL)CYCLOHEXANONE Specification
2-(1-METHYLPROPYL)CYCLOHEXANONE , its cas register number is 14765-30-1. It also can be called 2-(1-methylpropyl)-cyclohexanon ; 2-sec-butyl-cyclohexanon ; FRESKOMENTHE ; FEMA 3261 ; 2-SEC-BUTYLCYCLOHEXANONE .
It is hazardous. Moderately toxic by ingestion. Low toxicity by skin contact. When heated to decomposition it emits acrid smoke and irritating vapors. So put 2-(1-METHYLPROPYL)CYCLOHEXANONE (CAS NO.14765-30-1) out of the touch of children and keep it in cool place.
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