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CAS No.: | 638-04-0 |
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Name: | CIS-1,3-DIMETHYLCYCLOHEXANE |
Article Data: | 139 |
Molecular Structure: | |
Formula: | C8H16 |
Molecular Weight: | 112.215 |
Synonyms: | Cyclohexane,1,3-dimethyl-, cis- (8CI);NSC 74159;cis-1,3-Dimethylcyclohexane; |
EINECS: | 211-316-5 |
Density: | 0.784 g/mL at 25 °C(lit.) |
Melting Point: | -76 °C |
Boiling Point: | 120.1 °C at 760 mmHg |
Flash Point: | 9.4 °C |
Hazard Symbols: | F |
Risk Codes: | 11 |
Safety: | 16-29-33 |
Transport Information: | UN 2263 3 |
PSA: | 0.00000 |
LogP: | 2.83260 |
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The Cyclohexane,1,3-dimethyl-, (1R,3S)-rel-, with the CAS registry number 638-04-0, is also known as cis-1,3-Dimethylcyclohexane. It belongs to the product categories of Alkanes; Cyclic; Organic Building Blocks. Its EINECS registry number is 211-316-5. This chemical's molecular formula is C8H16 and molecular weight is 112.21264. Its IUPAC name is called (1S,3R)-1,3-dimethylcyclohexane. This chemical is clear colourless liquid.
Physical properties of Cyclohexane,1,3-dimethyl-, (1R,3S)-rel-: (1)ACD/LogP: 4.37; (2)Index of Refraction: 1.42; (3)Molar Refractivity: 37.08 cm3; (4)Molar Volume: 146.4 cm3; (5)Surface Tension: 22.4 dyne/cm; (6)Density: 0.766 g/cm3; (7)Flash Point: 9.4 °C; (8)Enthalpy of Vaporization: 34.34 kJ/mol; (9)Boiling Point: 120.1 °C at 760 mmHg; (10)Vapour Pressure: 18.6 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may catch fire in contact with air and only need brief contact with an ignition source which has a very low flash point or evolve highly flammable gases in contact with water. It is highly flammable. You should keep it away from sources of ignition - No smoking. You must take precautionary measures against static discharges.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1CCCC(C1)C
(2)Isomeric SMILES: C[C@@H]1CCC[C@@H](C1)C
(3)InChI: InChI=1S/C8H16/c1-7-4-3-5-8(2)6-7/h7-8H,3-6H2,1-2H3/t7-,8+
(4)InChIKey: SGVUHPSBDNVHKL-OCAPTIKFSA-N