2H-Pyran-2-one,tetrahydro-3,3-dimethyl- supplier

Name
3,3-DIMETHYL-TETRAHYDRO-PYRAN-2-ONE
EINECS
CAS No. 4830-05-1
Article Data26
CAS DataBase
Density 0.967 g/cm³
Solubility
Melting Point
Formula C₇H₁₂O₂
Boiling Point 206.3 °C at 760 mmHg
Molecular Weight 128.171
Flash Point 74.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Valericacid, 5-hydroxy-2,2-dimethyl-, d-lactone(7CI,8CI);NSC 134778;3,3-dimethyloxan-2-one;
PSA 26.30000
LogP 1.34960

2H-Pyran-2-one,tetrahydro-3,3-dimethyl- Specification

The CAS register number of 2H-Pyran-2-one,tetrahydro-3,3-dimethyl- is 4830-05-1. The IUPAC name about this chemical is 3,3-dimethyloxan-2-one. The molecular formula about this chemical is C₇H₁₂O₂ and the molecular weight is 128.17.

Physical properties about 2H-Pyran-2-one,tetrahydro-3,3-dimethyl- are: (1)ACD/LogP: 0.83; (2)#H bond acceptors: 2; (3)Polar Surface Area: 26.3 Å²; (4)Index of Refraction: 1.428; (5)Molar Refractivity: 34.11 cm³; (6)Molar Volume: 132.4 cm³; (7)Polarizability: 13.52x10^-24cm³; (8)Surface Tension: 27.2 dyne/cm; (9)Density: 0.967 g/cm³; (10)Flash Point: 74.8 °C; (11)Enthalpy of Vaporization: 44.26 kJ/mol; (12)Boiling Point: 206.3 °C at 760 mmHg; (13)Vapour Pressure: 0.239 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1OCCCC1(C)C
(2)InChI: InChI=1/C7H12O2/c1-7(2)4-3-5-9-6(7)8/h3-5H2,1-2H3
(3)InChIKey: CJNWCYZELLHABH-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C7H12O2/c1-7(2)4-3-5-9-6(7)8/h3-5H2,1-2H3
(5)Std. InChIKey: CJNWCYZELLHABH-UHFFFAOYSA-N

Product Name

3,3-DIMETHYL-TETRAHYDRO-PYRAN-2-ONE

2H-Pyran-2-one,tetrahydro-3,3-dimethyl- Specification

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