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Cas Database |
| Name |
2-(4-Methylphenyl)propan-2-ol |
EINECS | 214-817-7 |
| CAS No. | 1197-01-9 | Density | 0.979 g/cm3 |
| PSA | 20.23000 | LogP | 2.22240 |
| Solubility | Slightly soluble in water | Melting Point |
N/A |
| Formula | C10H14O | Boiling Point | 204.848 °C at 760 mmHg |
| Molecular Weight | 150.221 | Flash Point | 102.655 °C |
| Transport Information | N/A | Appearance | colourless to light yellow liquid with acelery-like odour |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
p-Cymen-8-ol(7CI,8CI);1-Methyl-4-(1-hydroxy-1-methylethyl)benzene;1-Methyl-4-(a-hydroxyisopropyl)benzene;2-(4-Methylphenyl)-2-propanol;2-(p-Methylphenyl)-2-propanol;2-(p-Tolyl)-2-propanol;4-Methylcumyl alcohol;8-Hydroxy-p-cymene;Dimethyl-p-tolyl carbinol;NSC 361057;p-Cymene-8-ol;a,a,4-Trimethylbenzyl alcohol; |
Article Data | 108 |
2-(4-Methylphenyl)propan-2-ol Specification
The 2-(4-Methylphenyl)propan-2-ol with the CAS number 1197-01-9 is also called Benzenemethanol, a,a,4-trimethyl-. Its EINECS registry number is 214-817-7. The molecular formula is C10H14O. This chemical belongs to the following product categories: (1)API intermediates; (2)Alphabetical Listings; (3)Flavors and Fragrances; (4)Q-Z.
The properties of the chemical are: (1)ACD/LogP: 2.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.19; (4)ACD/LogD (pH 7.4): 2.19; (5)ACD/BCF (pH 5.5): 27.26; (6)ACD/BCF (pH 7.4): 27.26; (7)ACD/KOC (pH 5.5): 370.86; (8)ACD/KOC (pH 7.4): 370.86; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.516; (14)Molar Refractivity: 46.36 cm3; (15)Molar Volume: 153.3 cm3; (16)Polarizability: 18.38×10-24cm3; (17)Surface Tension: 33.8 dyne/cm; (18)Enthalpy of Vaporization: 46.63 kJ/mol; (19)Vapour Pressure: 0.156 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(c1ccc(cc1)C)(C)C
(2)InChI: InChI=1/C10H14O/c1-8-4-6-9(7-5-8)10(2,3)11/h4-7,11H,1-3H3
(3)InChIKey: XLPDVYGDNRIQFV-UHFFFAOYAP
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