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Hexadecane,2,6,10,14-tetramethyl-

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Name

Hexadecane,2,6,10,14-tetramethyl-

EINECS 211-332-2
CAS No. 638-36-8 Density 0.784 g/cm3
Solubility Melting Point
Formula C20H42 Boiling Point 322.4 °C at 760 mmHg
Molecular Weight 282.55 Flash Point 150.2 °C
Transport Information Appearance
Safety 24/25 Risk Codes
Molecular Structure Molecular Structure of 638-36-8 (Hexadecane,2,6,10,14-tetramethyl-) Hazard Symbols
Synonyms

Phytane(6CI);2,6,10,14-Tetramethylhexadecane;Phytan;Tetrahydroneophytadiene;

 

Hexadecane,2,6,10,14-tetramethyl- Specification

The Hexadecane,2,6,10,14-tetramethyl-, with the CAS registry number 638-36-8, is also known as Tetrahydroneophytadiene. Its EINECS registry number is 211-332-2. This chemical's molecular formula is C20H42 and molecular weight is 282.55. What's more, both its IUPAC name and systematic name are the same which is called 2,6,10,14-Tetramethylhexadecane. When you are dealing with this chemical, you should avoid contact with skin and eyes.

Physical properties about Hexadecane,2,6,10,14-tetramethyl- are: (1)ACD/LogP: 10.65; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10.65; (4)ACD/LogD (pH 7.4): 10.65; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 13; (12)Index of Refraction: 1.437; (13)Molar Refractivity: 94.54 cm3; (14)Molar Volume: 360.1 cm3; (15)Polarizability: 37.47×10-24 cm3; (16)Surface Tension: 26.5 dyne/cm; (17)Density: 0.784 g/cm3; (18)Flash Point: 150.2 °C; (19)Enthalpy of Vaporization: 54.18 kJ/mol; (20)Boiling Point: 322.4 °C at 760 mmHg; (21)Vapour Pressure: 0.000526 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: C(CCCC(CCCC(C)CCCC(C)CC)C)(C)C
(2)InChI: InChI=1/C20H42/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h17-20H,7-16H2,1-6H3
(3)InChIKey: GGYKPYDKXLHNTI-UHFFFAOYAM

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