Benzene,2-(3,7-dimethyloctyl)-1,4-dimethyl- supplier

Name
1,4-DIMETHYL-2-(3,7-DIMETHYLOCTYL)BENZENE
EINECS
CAS No. 19550-60-8
Density 0.856 g/cm³
Solubility
Melting Point
Formula C₁₈H₃₀
Boiling Point 326.2 °C at 760 mmHg
Molecular Weight 246.43
Flash Point 147.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Octane,3,7-dimethyl-1-(2,5-xylyl)- (8CI);2,5-Dimethyl-1-(3,7-dimethyloctyl)benzene;NSC 112735;
PSA 0.00000
LogP 5.69840

Benzene,2-(3,7-dimethyloctyl)-1,4-dimethyl- Specification

The Benzene, 2-(3, 7-dimethyloctyl)-1, 4-dimethyl-, with the CAS registry number 19550-60-8, is also known as 1, 4-Dimethyl-2-(3, 7-dimethyloctyl)benzene. This chemical's molecular formula is C₁₈H₃₀ and molecular weight is 246.43. What's more, its IUPAC name is 2-(3, 7-Dimethyloctyl)-1, 4-dimethylbenzene.

Physical properties about Benzene, 2-(3, 7-dimethyloctyl)-1, 4-dimethyl- are: (1)ACD/LogP: 8.01; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.01; (4)ACD/LogD (pH 7.4): 8.01; (5)ACD/BCF (pH 5.5): 723920.13; (6)ACD/BCF (pH 7.4): 723920.13; (7)ACD/KOC (pH 5.5): 544422.63; (8)ACD/KOC (pH 7.4): 544422.63; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.485; (14)Molar Refractivity: 82.43 cm³; (15)Molar Volume: 287.6 cm³; (16)Polarizability: 32.67×10^-24 cm³; (17)Surface Tension: 29.8 dyne/cm; (18)Density: 0.856 g/cm³; (19)Flash Point: 147.1 °C; (20)Enthalpy of Vaporization: 54.58 kJ/mol; (21)Boiling Point: 326.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000415 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(ccc(c1CCC(C)CCCC(C)C)C)C
(2) InChI: InChI=1/C18H30/c1-14(2)7-6-8-15(3)10-12-18-13-16(4)9-11-17(18)5/h9,11,13-15H,6-8,10,12H2,1-5H3
(3) InChIKey: GDGPOTBJJLOPRZ-UHFFFAOYAN

Product Name

1,4-DIMETHYL-2-(3,7-DIMETHYLOCTYL)BENZENE

Benzene,2-(3,7-dimethyloctyl)-1,4-dimethyl- Specification

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