Methyl 3-(4-chlorosulfonyl)phenylpropionate supplier

Name
METHYL 3-(4-CHLOROSULFONYL)PHENYLPROPIONATE
EINECS
CAS No. 374537-95-8
Article Data2
CAS DataBase
Density 1.344 g/cm³
Solubility
Melting Point 64-65 °C
Formula C₁₀H₁₁ClO₄S
Boiling Point 352 °C at 760 mmHg
Molecular Weight 262.714
Flash Point 166.7 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 34
Molecular Structure
Hazard Symbols R34:Causes burns.;
Synonyms 3-(4-Chlorosulfonylphenyl)propionicacid methyl ester;Methyl 3-(4-chlorosulfonylphenyl)propionate;Methyl4-chlorosulfonylbenzenepropanoate;
PSA 68.82000
LogP 2.80050

Methyl 3-(4-chlorosulfonyl)phenylpropionate Specification

The Methyl 3-(4-chlorosulfonyl)phenylpropionate, with the CAS registry number 374537-95-8, is also known as Benzenepropanoic acid, 4-(chlorosulfonyl)-, methyl ester. This chemical's molecular formula is C₁₀H₁₁ClO₄S and molecular weight is 262.71. Its systematic name is called methyl 3-[4-(chlorosulfonyl)phenyl]propanoate.

Physical properties of Methyl 3-(4-chlorosulfonyl)phenylpropionate: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.03; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 20.45; (6)ACD/BCF (pH 7.4): 20.45; (7)ACD/KOC (pH 5.5): 301.89; (8)ACD/KOC (pH 7.4): 301.89; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Index of Refraction: 1.534; (13)Molar Refractivity: 60.77 cm³; (14)Molar Volume: 195.4 cm³; (15)Surface Tension: 45 dyne/cm; (16)Density: 1.344 g/cm³; (17)Flash Point: 166.7 °C; (18)Enthalpy of Vaporization: 59.68 kJ/mol; (19)Boiling Point: 352 °C at 760 mmHg; (20)Vapour Pressure: 3.96E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: ClS(=O)(=O)c1ccc(CCC(=O)OC)cc1
(2)InChI: InChI=1/C10H11ClO4S/c1-15-10(12)7-4-8-2-5-9(6-3-8)16(11,13)14/h2-3,5-6H,4,7H2,1H3
(3)InChIKey: MLBUSWRSGABXFY-UHFFFAOYAJ

Product Name

METHYL 3-(4-CHLOROSULFONYL)PHENYLPROPIONATE

Methyl 3-(4-chlorosulfonyl)phenylpropionate Specification

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