Butane,1-chloro-4-(methylsulfinyl)- supplier

Name
1-chloro-4-methylsulfinyl-butane
EINECS
CAS No. 53394-81-3
Density 1.172 g/cm³
Solubility
Melting Point
Formula C₅H₁₁ClOS
Boiling Point 298.6 °C at 760 mmHg
Molecular Weight 154.661
Flash Point 134.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Chlorobutylmethyl sulfoxide;4-Chlorobutyl methyl sulfoxide;
PSA 36.28000
LogP 2.24960

Butane,1-chloro-4-(methylsulfinyl)- Specification

The Butane,1-chloro-4-(methylsulfinyl)-, with the CAS registry number 53394-81-3, is also known as 4-Chlorobutyl methyl sulfoxide. This chemical's molecular formula is C₅H₁₁ClOS and molecular weight is 154.6582. What's more, its systematic name is 1-Chloro-4-methylsulfinyl-butane.

Physical properties about Butane,1-chloro-4-(methylsulfinyl)- are: (1)ACD/LogP: 0.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.08; (4)ACD/LogD (pH 7.4): 0.08; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 36.28 Å²; (9)Index of Refraction: 1.501; (10)Molar Refractivity: 38.92 cm³; (11)Molar Volume: 131.9 cm³; (12)Polarizability: 15.43×10^-24 cm³; (13)Surface Tension: 44.3 dyne/cm; (14)Density: 1.172 g/cm³; (15)Flash Point: 134.4 °C; (16)Enthalpy of Vaporization: 51.7 kJ/mol; (17)Boiling Point: 298.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00223 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CS(=O)CCCCCl
(2) InChI: InChI=1/C5H11ClOS/c1-8(7)5-3-2-4-6/h2-5H2,1H3
(3) InChIKey: HJVWKFAXJLSSAW-UHFFFAOYAS

Product Name

1-chloro-4-methylsulfinyl-butane

Butane,1-chloro-4-(methylsulfinyl)- Specification

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