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CAS No.: | 10557-44-5 |
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Name: | CIS-2,5-DIMETHYL-3-HEXENE |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C8H16 |
Molecular Weight: | 112.215 |
Synonyms: | 3-Hexene,2,5-dimethyl-, (Z)- (8CI);(Z)-1,2-Diisopropylethylene;(Z)-2,5-Dimethyl-3-hexene;2,5-Dimethyl-cis-3-hexene;cis-1,2-Diisopropylethylene;cis-2,5-Dimethyl-3-hexene;cis-Diisopropylethylene; |
Density: | 0.724 g/cm3 |
Melting Point: | -103.01°C (estimate) |
Boiling Point: | 102 °C at 760 mmHg |
Flash Point: | 8.4 °C |
PSA: | 0.00000 |
LogP: | 2.85460 |
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The 3-Hexene, 2,5-dimethyl-, (Z)-, with the CAS registry number 10557-44-5, is also known as cis-1,2-Diisopropylethylene. This chemical's molecular formula is C8H16 and molecular weight is 112.21. What's more, its IUPAC name is (Z)-2,5-dimethylhex-3-ene.
Physical properties of 3-Hexene, 2,5-dimethyl-, (Z)- are: (1)ACD/LogP: 4.12; (2)# of Rule of 5 Violations: 0; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.418; (5)Molar Refractivity: 39.08 cm3; (6)Molar Volume: 154.9 cm3; (7)Polarizability: 15.49×10-24cm3; (8)Surface Tension: 21.1 dyne/cm; (9)Density: 0.724 g/cm3; (10)Flash Point: 8.4 °C; (11)Enthalpy of Vaporization: 32.71 kJ/mol; (12)Boiling Point: 102 °C at 760 mmHg; (13)Vapour Pressure: 39.6 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)C=CC(C)C
(2)Isomeric SMILES: CC(C)/C=C\C(C)C
(3)InChI: InChI=1S/C8H16/c1-7(2)5-6-8(3)4/h5-8H,1-4H3/b6-5-
(4)InChIKey: KNCMKWVOMRUHKZ-WAYWQWQTSA-N