1-Octanol, 4,6-dimethyl- supplier

Name
4,6-dimethyloctan-1-ol
EINECS 266-460-1
CAS No. 66719-33-3
Density 0.824 g/cm³
Solubility
Melting Point -1.53°C (estimate)
Formula C₁₀H₂₂O
Boiling Point 206.4 °C at 760 mmHg
Molecular Weight 158.284
Flash Point 87.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4,6-dimethyloctan-1-ol
PSA 20.23000
LogP 2.83120

1-Octanol, 4,6-dimethyl- Specification

This chemical is called 1-Octanol, 4,6-dimethyl-, and its systematic name is 4,6-dimethyloctan-1-ol. With the molecular formula of C₁₀H₂₂O, its molecular weight is 158.28. The CAS registry number of this chemical is 66719-33-3.

Other characteristics of the 1-Octanol, 4,6-dimethyl- can be summarised as followings: (1)ACD/LogP: 3.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.7; (4)ACD/LogD (pH 7.4): 3.7; (5)ACD/BCF (pH 5.5): 378.88; (6)ACD/BCF (pH 7.4): 378.88; (7)ACD/KOC (pH 5.5): 2439.47; (8)ACD/KOC (pH 7.4): 2439.47; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.432; (14)Molar Refractivity: 49.82 cm³; (15)Molar Volume: 191.8 cm³; (16)Polarizability: 19.75×10^-24cm³; (17)Surface Tension: 28 dyne/cm; (18)Density: 0.824 g/cm³; (19)Flash Point: 87.9 °C; (20)Enthalpy of Vaporization: 51.49 kJ/mol; (21)Boiling Point: 206.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0561 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: OCCCC(CC(CC)C)C
2.InChI: InChI=1/C10H22O/c1-4-9(2)8-10(3)6-5-7-11/h9-11H,4-8H2,1-3H3
3.InChIKey: JOWDWXPTKVUHBV-UHFFFAOYAE

Product Name

4,6-dimethyloctan-1-ol

1-Octanol, 4,6-dimethyl- Specification

Related Products

Hot Products