Decane, 1-(methylsulfinyl)- supplier

Name
DECYL METHYL SULFOXIDE
EINECS 221-368-0
CAS No. 3079-28-5
Article Data13
CAS DataBase
Density 0.93 g/cm³
Solubility
Melting Point 52-53 °C
Formula C₁₁H₂₄OS
Boiling Point 325.4 °C at 760 mmHg
Molecular Weight 204.377
Flash Point 150.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Sulfoxide,decyl methyl (6CI,7CI,8CI);Decyl methyl sulfoxide;n-Decyl methyl sulfoxide;
PSA 36.28000
LogP 4.37130

Decane, 1-(methylsulfinyl)- Specification

This chemical is called Decane, 1-(methylsulfinyl)-, and its systematic name is 1-Decyl methyl sulfoxide. With the molecular formula of C₁₁H₂₄OS, its molecular weight is 204.38. The CAS registry number of this chemical is 3079-28-5.

Other characteristics of the Decane, 1-(methylsulfinyl)- can be summarised as followings: (1)ACD/LogP: 3.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.43; (4)ACD/LogD (pH 7.4): 3.43; (5)ACD/BCF (pH 5.5): 239.02; (6)ACD/BCF (pH 7.4): 239.02; (7)ACD/KOC (pH 5.5): 1754.24; (8)ACD/KOC (pH 7.4): 1754.24; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 36.28 Å²; (13)Index of Refraction: 1.475; (14)Molar Refractivity: 61.87 cm³; (15)Molar Volume: 219.6 cm³; (16)Polarizability: 24.52×10^-24cm³; (17)Surface Tension: 36.7 dyne/cm; (18)Density: 0.93 g/cm³; (19)Flash Point: 150.6 °C; (20)Enthalpy of Vaporization: 54.5 kJ/mol; (21)Boiling Point: 325.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000438 mmHg at 25°C.

Production method of this chemical: The Decane, 1-(methylsulfinyl)- could be obtained by the reactant of diethyl (methylsulfinyl)methylphosphonate. This reaction should be taken for 1 hour at the ambient temperature. The yield is 46%.

The Decane, 1-(methylsulfinyl)- could be obtained by the reactant of diethyl (methylsulfinyl)methylphosphonate

You can still convert the following datas into molecular structure:
1.SMILES: O=S(CCCCCCCCCC)C
2.InChI: InChI=1/C11H24OS/c1-3-4-5-6-7-8-9-10-11-13(2)12/h3-11H2,1-2H3
3.InChIKey: NZJXADCEESMBPW-UHFFFAOYAC

Product Name

DECYL METHYL SULFOXIDE

Decane, 1-(methylsulfinyl)- Specification

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