Methanol,1-[(4-methylphenyl)sulfonyl]- supplier

Name
(p-tolylsulphonyl)methanol
EINECS 218-563-8
CAS No. 2182-69-6
Density 1.284 g/cm³
Solubility
Melting Point
Formula C₈H₁₀O₃S
Boiling Point 373.2 °C at 760 mmHg
Molecular Weight 186.232
Flash Point 179.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methanol,(p-tolylsulfonyl)- (6CI,7CI,8CI);Methanol, [(4-methylphenyl)sulfonyl]- (9CI);(p-Tolylsulfonyl)methanol;Hydroxymethyl p-tolyl sulfone;NSC 227513;NSC85914;p-Tolyl hydroxymethylsulfone;Methanol, ((4-methylphenyl)sulfonyl)-;Hydroxymethyl p-tolyl sulfone;methanol, 1-[(4-methylphenyl)sulfonyl]-;
PSA 62.75000
LogP 1.79930

Methanol,1-[(4-methylphenyl)sulfonyl]- Specification

The Methanol,1-[(4-methylphenyl)sulfonyl]-, with the CAS registry number 2182-69-6 and EINECS registry number218-563-8, has the systematic name of [(4-methylphenyl)sulfonyl]methanol. It is also called Hydroxymethyl p-tolyl sulfone. And the molecular formula of this chemical is C₈H₁₀O₃S.

The physical properties of Methanol,1-[(4-methylphenyl)sulfonyl]- are as following: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.49; (4)ACD/LogD (pH 7.4): 0.49; (5)ACD/BCF (pH 5.5): 1.4; (6)ACD/BCF (pH 7.4): 1.4; (7)ACD/KOC (pH 5.5): 44.25; (8)ACD/KOC (pH 7.4): 44.25; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 51.75 Å²; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 46.35 cm³; (15)Molar Volume: 144.9 cm³; (16)Polarizability: 18.37×10^-24cm³; (17)Surface Tension: 46.4 dyne/cm; (18)Density: 1.284 g/cm³; (19)Flash Point: 179.5 °C; (20)Enthalpy of Vaporization: 65.45 kJ/mol; (21)Boiling Point: 373.2 °C at 760 mmHg; (22)Vapour Pressure: 3.13E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1ccc(cc1)C)CO
(2)InChI: InChI=1/C8H10O3S/c1-7-2-4-8(5-3-7)12(10,11)6-9/h2-5,9H,6H2,1H3
(3)InChIKey: BXEXEGLXXGXRHP-UHFFFAOYAX

Product Name

(p-tolylsulphonyl)methanol

Methanol,1-[(4-methylphenyl)sulfonyl]- Specification

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