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3675-21-6

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Basic Information
CAS No.: 3675-21-6
Name: NSC3932
Article Data: 2
Molecular Structure:
Molecular Structure of 3675-21-6 (NSC3932)
Formula: C6H10O2
Molecular Weight: 114.144
Synonyms: 3-Methyl-pent-2-enoic acid;NSC3932;
Density: 0.987 g/cm3
Boiling Point: 207.6 °C at 760 mmHg
Flash Point: 113.9 °C
PSA: 37.30000
LogP: 1.42730
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Specification

The CAS register number of (Z)-3-Methylpent-2-enoic acid is 3675-21-6. The molecular formula about this chemical is C6H10O2 and the molecular weight is 114.143.

Physical properties about (Z)-3-Methylpent-2-enoic acid are: (1)ACD/LogP: 1.89; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 26.3 Å2; (6)Index of Refraction: 1.454; (7)Molar Refractivity: 31.31 cm3; (8)Molar Volume: 115.6 cm3; (9)Polarizability: 12.41x10-24cm3; (10)Surface Tension: 32.4 dyne/cm; (11)Density: 0.987 g/cm3; (12)Flash Point: 113.9 °C; (13)Enthalpy of Vaporization: 48.91 kJ/mol; (14)Boiling Point: 207.6 °C at 760 mmHg; (15)Vapour Pressure: 0.0899 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C=C(C)CC
(2)InChI: InChI=1/C6H10O2/c1-3-5(2)4-6(7)8/h4H,3H2,1-2H3,(H,7,8)
(3)InChIKey: RSFQOQOSOMBPEJ-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C6H10O2/c1-3-5(2)4-6(7)8/h4H,3H2,1-2H3,(H,7,8)
(5)Std. InChIKey: RSFQOQOSOMBPEJ-UHFFFAOYSA-N