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| CAS No.: | 14073-97-3 |
|---|---|
| Name: | L-MENTHONE |
| Molecular Structure: | |
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| Formula: | C10H18O |
| Molecular Weight: | 154.252 |
| Synonyms: | Cyclohexanone,5-methyl-2-(1-methylethyl)-, (2S-trans)-;p-Menthan-3-one, (1R,4S)-(-)- (8CI);(-)-Menthone;(1R,4S)-Menthone;(1R,4S)-p-Menth-3-one;(1R,4S)-p-Menthan-3-one;(2S,5R)-(-)-Menthone;(2S,5R)-2-Isopropyl-5-methylcyclohexan-1-one;(2S,5R)-2-Isopropyl-5-methylcyclohexanone;l-Menthone;trans-(-)-p-Menthan-3-one; |
| EINECS: | 233-944-9 |
| Density: | 0.881 g/cm3 |
| Melting Point: | -6 °C |
| Boiling Point: | 204.999 °C at 760 mmHg |
| Flash Point: | 72.778 °C |
| Solubility: | 496.7mg/L(25 oC) |
| Appearance: | clear colorless to pale yellow liquid |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 43 |
| Safety: | 36/37-24/25-23 |
| PSA: | 17.07000 |
| LogP: | 2.64770 |
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Specification
This chemical is called Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2S,5R)-, and its systematic name is (2S,5R)-5-methyl-2-(propan-2-yl)cyclohexanone. With the molecular formula of C10H18O, its molecular weight is 154.25. The CAS registry number of this chemical is 14073-97-3. Additionally, its product categories are Biochemistry; Monocyclic Monoterpenes; Terpenes.
Other characteristics of the Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2S,5R)- can be summarised as followings: (1)ACD/LogP: 2.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.63; (4)ACD/LogD (pH 7.4): 2.63; (5)ACD/BCF (pH 5.5): 58.22; (6)ACD/BCF (pH 7.4): 58.22; (7)ACD/KOC (pH 5.5): 638.3; (8)ACD/KOC (pH 7.4): 638.3; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.442; (14)Molar Refractivity: 46.37 cm3; (15)Molar Volume: 175 cm3; (16)Polarizability: 18.38×10-24cm3; (17)Surface Tension: 27.2 dyne/cm; (18)Density: 0.881 g/cm3; (19)Flash Point: 72.8 °C; (20)Enthalpy of Vaporization: 44.12 kJ/mol; (21)Boiling Point: 205 °C at 760 mmHg; (22)Vapour Pressure: 0.256 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical may cause sensitization by skin contact. You should wear suitable protective clothing to avoid contacting with skin and eyes. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: O=C1C[C@H](C)CC[C@H]1C(C)C
2.InChI: InChI=1/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9+/m1/s1
3.InChIKey: NFLGAXVYCFJBMK-BDAKNGLRBF