4,4-Dimethoxycyclohexanone supplier

Name
Cyclohexanone, 4,4-dimethoxy-
EINECS
CAS No. 56180-50-8
Article Data6
CAS DataBase
Density 1.038 g/cm³
Solubility
Melting Point
Formula C₈H₁₄O₃
Boiling Point 212.646 °C at 760 mmHg
Molecular Weight 158.197
Flash Point 72.647 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Cyclohexanone, 4,4-dimethoxy-
PSA
LogP

4,4-Dimethoxycyclohexanone Specification

The 4,4-Dimethoxycyclohexanone, with the CAS registry number 56180-50-8, is also known as Cyclohexanone, 4,4-dimethoxy-. This chemical's molecular formula is C₈H₁₄O₃ and molecular weight is 158.20. What's more, its systematic name is 4,4-Dimethoxycyclohexanone.

Physical properties of 4,4-Dimethoxycyclohexanone are: (1)ACD/LogP: -0.134; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.13; (4)ACD/LogD (pH 7.4): -0.13; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 20.14; (8)ACD/KOC (pH 7.4): 20.14; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.446; (14)Molar Refractivity: 40.646 cm³; (15)Molar Volume: 152.467 cm³; (16)Polarizability: 16.113×10^-24cm³; (17)Surface Tension: 32.1 dyne/cm; (18)Density: 1.038 g/cm³; (19)Flash Point: 72.647 °C; (20)Enthalpy of Vaporization: 44.895 kJ/mol; (21)Boiling Point: 212.646 °C at 760 mmHg; (22)Vapour Pressure: 0.2 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1CCC(OC)(OC)CC1
(2)Std. InChI: InChI=1S/C8H14O3/c1-10-8(11-2)5-3-7(9)4-6-8/h3-6H2,1-2H3
(3)Std. InChIKey: UOJCLZFJKRTXGV-UHFFFAOYSA-N

Product Name

Cyclohexanone, 4,4-dimethoxy-

4,4-Dimethoxycyclohexanone Specification

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