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EINECS 265-739-5
CAS No. 65405-68-7 Density 0.926 g/cm3
PSA 37.30000 LogP 1.37410
Solubility N/A Melting Point 10.61oC
Formula C8H16O2 Boiling Point 226.3 °C at 760 mmHg
Molecular Weight 144.214 Flash Point 91.4 °C
Transport Information N/A Appearance colorless clear liquid
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 65405-68-7 (3-(hydroxymethyl)heptan-2-one) Hazard Symbols N/A



2-Heptanone,3-(hydroxymethyl)- Specification

The CAS register number of 2-Heptanone,3-(hydroxymethyl)- is 65405-68-7. It also can be called as 3-Butyl-4-hydroxy-2-butanone and the IUPAC name about this chemical is 3-(hydroxymethyl)heptan-2-one. The molecular formula about this chemical is C8H16O2 and the molecular weight is 144.21144. It belongs to the following product category which includes ketone Flavor.

Physical properties about 2-Heptanone,3-(hydroxymethyl)- are: (1)ACD/LogP: 1.16; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 6; (5)Polar Surface Area: 26.3 Å2; (6)Index of Refraction: 1.435; (7)Molar Refractivity: 40.63 cm3; (8)Molar Volume: 155.5 cm3; (9)Polarizability: 16.1x10-24cm3; (10)Surface Tension: 31.8 dyne/cm; (11)Density: 0.926 g/cm3; (12)Flash Point: 91.4 °C; (13)Enthalpy of Vaporization: 53.82 kJ/mol; (14)Boiling Point: 226.3 °C at 760 mmHg; (15)Vapour Pressure: 0.0163 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(2)InChI: InChI=1/C8H16O2/c1-3-4-5-8(6-9)7(2)10/h8-9H,3-6H2,1-2H3
(4)Std. InChI: InChI=1S/C8H16O2/c1-3-4-5-8(6-9)7(2)10/h8-9H,3-6H2,1-2H3

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