Methyl(E)-4-hexenoate supplier

Name
4-Hexenoic acid, methyl ester, (4E)-
EINECS
CAS No. 14017-81-3
Article Data2
CAS DataBase
Density 0.907 g/cm³
Solubility
Melting Point
Formula C₇H₁₂O₂
Boiling Point 126 °C at 760 mmHg
Molecular Weight 128.171
Flash Point 40.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methyl (4E)-hex-4-enoate;4-Hexenoic acid, methyl ester, (E)- (8CI);Methyl trans-4-hexenoate;
PSA
LogP

Methyl(E)-4-hexenoate Specification

The 4-Hexenoic acid, methyl ester, (4E)- has the CAS registry number 14017-81-3. This chemical's molecular formula is C₇H₁₂O₂ and molecular weight is 128.17. What's more, its systematic name is methyl (4E)-hex-4-enoate.

Physical properties of 4-Hexenoic acid, methyl ester, (4E)- are: (1)ACD/LogP: 1.98; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 26.3 Å²; (7)Index of Refraction: 1.427; (8)Molar Refractivity: 36.31 cm³; (9)Molar Volume: 141.1 cm³; (10)Polarizability: 14.39×10^-24cm³; (11)Surface Tension: 27.2 dyne/cm; (12)Density: 0.907 g/cm³; (13)Flash Point: 40.1 °C; (14)Enthalpy of Vaporization: 36.38 kJ/mol; (15)Boiling Point: 126 °C at 760 mmHg; (16)Vapour Pressure: 11.9 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)CC/C=C/C
(2)Std. InChI: InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h3-4H,5-6H2,1-2H3/b4-3+
(3)Std. InChIKey: MEZYCNMPBPQTLK-ONEGZZNKSA-N

Product Name

4-Hexenoic acid, methyl ester, (4E)-

Methyl(E)-4-hexenoate Specification

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