3-Heptene, 4-methyl- supplier

Name
4-METHYL HEPTENE-3
EINECS
CAS No. 4485-16-9
Density 0.728 g/cm³
Solubility
Melting Point -103.01°C (estimate)
Formula C₈H₁₆
Boiling Point 120 °C at 760 mmHg
Molecular Weight 112.215
Flash Point 9.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Methyl-3-heptene;NSC 158671;
PSA 0.00000
LogP 3.14280

3-Heptene, 4-methyl- Specification

The 3-Heptene, 4-methyl-, with the CAS registry number of 4485-16-9, is also known as cis/trans-3-Heptene, 4-methyl-. This chemical's molecular formula is C₈H₁₆ and molecular weight is 112.21. What's more, its IUPAC name is (E)-4-Methylhept-3-ene.

Physical properties about 3-Heptene, 4-methyl- are: (1)ACD/LogP: 4.51; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 0 Å²; (7)Index of Refraction: 1.42; (8)Molar Refractivity: 39.01 cm³; (9)Molar Volume: 154 cm³; (10)Surface Tension: 22 dyne/cm; (11)Density: 0.728 g/cm³; (12)Flash Point: 9.2 °C; (13)Enthalpy of Vaporization: 34.33 kJ/mol; (14)Boiling Point: 120 °C at 760 mmHg; (15)Vapour Pressure: 18.6 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C(=C(\C)CCC)\CC
(2) InChI: InChI=1/C8H16/c1-4-6-8(3)7-5-2/h6H,4-5,7H2,1-3H3/b8-6+
(3) InChIKey: KKVVJQGDNYIIMN-SOFGYWHQBI

Product Name

4-METHYL HEPTENE-3

3-Heptene, 4-methyl- Specification

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