Aceticacid, 2-[(diphenylmethyl)thio]-, ethyl ester supplier

Name
ACETIC ACID, [(DIPHENYLMETHYL)THIO]-, ETHYL ESTER
EINECS
CAS No. 63547-23-9
Article Data6
CAS DataBase
Density 1.131 g/cm³
Solubility
Melting Point
Formula C₁₇H₁₈O₂S
Boiling Point 384.3 °C at 760 mmHg
Molecular Weight 286.395
Flash Point 176.9 °C
Transport Information
Appearance slight-yellow oil
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Aceticacid, [(diphenylmethyl)thio]-, ethyl ester (9CI);
PSA 51.60000
LogP 4.07230

Aceticacid, 2-[(diphenylmethyl)thio]-, ethyl ester Specification

The Aceticacid, 2-[(diphenylmethyl)thio]-, ethyl ester, with the CAS registry number 63547-23-9, belongs to the product categories of Aromatics Compounds; Aromatics; Sulfur & Selenium Compounds. This chemical's molecular formula is C₁₇H₁₈O₂S and molecular weight is 286.3886. Its systematic name is called ethyl [(diphenylmethyl)sulfanyl]acetate. This chemical is slight-yellow oil.

Physical properties of Aceticacid, 2-[(diphenylmethyl)thio]-, ethyl ester: (1)ACD/LogP: 4.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.93; (4)ACD/LogD (pH 7.4): 4.93; (5)ACD/BCF (pH 5.5): 3286.53; (6)ACD/BCF (pH 7.4): 3286.53; (7)ACD/KOC (pH 5.5): 11451.85; (8)ACD/KOC (pH 7.4): 11451.85; (9)#H bond acceptors: 2; (10)#Freely Rotating Bonds: 7; (11)Index of Refraction: 1.577; (12)Molar Refractivity: 83.87 cm³; (13)Molar Volume: 253 cm³; (14)Surface Tension: 43.9 dyne/cm; (15)Density: 1.131 g/cm³; (16)Flash Point: 176.9 °C; (17)Enthalpy of Vaporization: 63.3 kJ/mol; (18)Boiling Point: 384.3 °C at 760 mmHg; (19)Vapour Pressure: 4.13E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)CSC(c1ccccc1)c2ccccc2
(2)InChI: InChI=1/C17H18O2S/c1-2-19-16(18)13-20-17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,17H,2,13H2,1H3
(3)InChIKey: USHWCUHXXAVVLF-UHFFFAOYAN

Product Name

ACETIC ACID, [(DIPHENYLMETHYL)THIO]-, ETHYL ESTER

Aceticacid, 2-[(diphenylmethyl)thio]-, ethyl ester Specification

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