2-Cyclohexen-1-one,2-hydroxy- supplier

Name
2-Cyclohexen-1-one, 2-hydroxy-
EINECS
CAS No. 10316-66-2
Article Data8
CAS DataBase
Density 1.229 g/cm³
Solubility
Melting Point 30 °C
Formula C₆H₈O₂
Boiling Point 256.6 °C at 760 mmHg
Molecular Weight 112.128
Flash Point 106.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Methyl-3,4-cyclohexanedione;
PSA 37.30000
LogP 1.18130

2-Cyclohexen-1-one,2-hydroxy- Specification

The 2-Cyclohexen-1-one,2-hydroxy-, with the CAS registry number of 10316-66-2, is also known as 2-Methyl-3,4-cyclohexanedione. This chemical's molecular formula is C₆H₈O₂. What's more, its IUPAC name is 2-Hydroxycyclohex-2-en-1-one.

Physical properties about the 2-Cyclohexen-1-one,2-hydroxy- are: (1)ACD/LogP: 0.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.21; (4)ACD/LogD (pH 7.4): 0.2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 31.13; (8)ACD/KOC (pH 7.4): 30.01; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.548; (14)Molar Refractivity: 28.99 cm³; (15)Molar Volume: 91.2 cm³; (16)Surface Tension: 53.5 dyne/cm; (17)Density: 1.229 g/cm³; (18)Flash Point: 106.2 °C; (19)Enthalpy of Vaporization: 57.4 kJ/mol; (20)Boiling Point: 256.6 °C at 760 mmHg; (21)Vapour Pressure: 0.00228 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C1C(\O)=C/CCC1
(2) InChI: InChI=1/C6H8O2/c7-5-3-1-2-4-6(5)8/h3,7H,1-2,4H2
(3) InChIKey: JQPFYXFVUKHERX-UHFFFAOYAS

Product Name

2-Cyclohexen-1-one, 2-hydroxy-

2-Cyclohexen-1-one,2-hydroxy- Specification

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