2-Pentanol,2,3,4-trimethyl- supplier

Name
2,3,4-trimethylpentan-2-ol
EINECS
CAS No. 66576-26-9
Article Data3
CAS DataBase
Density 0.819 g/cm³
Solubility
Melting Point -61.15°C (estimate)
Formula C₈H₁₈O
Boiling Point 150.4 °C at 760 mmHg
Molecular Weight 130.23
Flash Point 50 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,3,4-trimethylpentan-2-ol
PSA 20.23000
LogP 2.04940

2-Pentanol,2,3,4-trimethyl- Specification

The 2-Pentanol,2,3,4-trimethyl- is an organic compound with the formula C₈H₁₈O. The IUPAC name of this chemical is 2,3,4-trimethylpentan-2-ol. With the CAS registry number 66576-26-9, it is also named as 2,3,4-Trimethyl-2-pentanol.

Physical properties about 2-Pentanol,2,3,4-trimethyl- are: (1)ACD/LogP: 2.27; (2)ACD/LogD (pH 5.5): 2.27; (3)ACD/LogD (pH 7.4): 2.27; (4)ACD/BCF (pH 5.5): 31.11; (5)ACD/BCF (pH 7.4): 31.11; (6)ACD/KOC (pH 5.5): 407.56; (7)ACD/KOC (pH 7.4): 407.56; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 9.23 Å²; (12)Index of Refraction: 1.423; (13)Molar Refractivity: 40.52 cm³; (14)Molar Volume: 158.8 cm³; (15)Polarizability: 16.06×10^-24cm³; (16)Surface Tension: 25.4 dyne/cm; (17)Density: 0.819 g/cm³; (18)Flash Point: 50 °C; (19)Enthalpy of Vaporization: 45.11 kJ/mol; (20)Boiling Point: 150.4 °C at 760 mmHg; (21)Vapour Pressure: 1.46 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(C)(C)C(C)C(C)C
(2)InChI: InChI=1/C8H18O/c1-6(2)7(3)8(4,5)9/h6-7,9H,1-5H3
(3)InChIKey: FTPXXARYDFWPGE-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C8H18O/c1-6(2)7(3)8(4,5)9/h6-7,9H,1-5H3
(5)Std. InChIKey: FTPXXARYDFWPGE-UHFFFAOYSA-N

Product Name

2,3,4-trimethylpentan-2-ol

2-Pentanol,2,3,4-trimethyl- Specification

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