Ethyl 2-(4-chlorophenylsulfinyl)acetate supplier

Name
Ethyl 2-(4-chlorophenylsulfinyl)acetate
EINECS
CAS No. 91077-12-2
Article Data3
CAS DataBase
Density 1.36 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₁ClO₃S
Boiling Point 384 °C at 760 mmHg
Molecular Weight 246.715
Flash Point 186 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ethyl 2-(4-chlorophenylsulfinyl)acetate
PSA 62.58000
LogP 2.87640

Ethyl 2-(4-chlorophenylsulfinyl)acetate Specification

This chemical is called Ethyl 2-(4-chlorophenylsulfinyl)acetate, and it can also be named as acetic acid, 2-[(4-chlorophenyl)sulfinyl]-, ethyl ester. With the molecular formula of C₁₀H₁₁ClO₃S, its molecular weight is 246.71. The CAS registry number of this chemical is 91077-12-2.

Other characteristics of the Ethyl 2-(4-chlorophenylsulfinyl)acetate can be summarised as followings: (1)ACD/LogP: 1.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.76; (4)ACD/LogD (pH 7.4): 1.76; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 62.58 Å²; (9)Index of Refraction: 1.587; (10)Molar Refractivity: 60.83 cm³; (11)Molar Volume: 180.8 cm³; (12)Polarizability: 24.11×10^-24cm³; (13)Surface Tension: 58.1 dyne/cm; (14)Density: 1.36 g/cm³; (15)Flash Point: 186 °C; (16)Enthalpy of Vaporization: 63.26 kJ/mol; (17)Boiling Point: 384 °C at 760 mmHg; (18)Vapour Pressure: 4.22E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: CCOC(=O)CS(=O)c1ccc(cc1)Cl
2.InChI: InChI=1/C10H11ClO3S/c1-2-14-10(12)7-15(13)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3
3.InChIKey: AWLUBZLGOYLMQT-UHFFFAOYAN

Product Name

Ethyl 2-(4-chlorophenylsulfinyl)acetate

Ethyl 2-(4-chlorophenylsulfinyl)acetate Specification

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