5-(4-Hydroxybenzyl)-1,3-thiazolidine-2,4-dione supplier

Name
2,4-Thiazolidinedione,5-[(4-hydroxyphenyl)methyl]-
EINECS
CAS No. 74772-78-4
Article Data20
CAS DataBase
Density 1.45 g/cm³
Solubility
Melting Point 145-147°C
Formula C₁₀H₉NO₃S
Boiling Point 471.516 °C at 760 mmHg
Molecular Weight 223.252
Flash Point 238.965 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-(4-Hydroxybenzyl)thiazolidine-2,4-dione;U 90441;
PSA 91.70000
LogP 1.61510

5-(4-Hydroxybenzyl)-1,3-thiazolidine-2,4-dione Specification

The CAS register number of 5-(4-Hydroxybenzyl)-1,3-thiazolidine-2,4-dione is 74772-78-4. It also can be called as 2,4-Thiazolidinedione,5-[(4-hydroxyphenyl)methyl]- and the systematic name about this chemical is 5-(4-hydroxybenzyl)-1,3-thiazolidine-2,4-dione. The molecular formula about this chemical is C₁₀H₉NO₃S and the molecular weight is 223.25. It belongs to the Pharmaceutical Intermediates.

Physical properties about 5-(4-Hydroxybenzyl)-1,3-thiazolidine-2,4-dione are: (1)ACD/LogP: 1.19; (2)ACD/LogD (pH 5.5): 1; (3)ACD/BCF (pH 5.5): 3; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 66; (6)ACD/KOC (pH 7.4): 7; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 91.7Å²; (11)Index of Refraction: 1.657; (12)Molar Refractivity: 56.655 cm³; (13)Molar Volume: 153.953 cm³; (14)Polarizability: 22.46x10^-24cm³; (15)Surface Tension: 65.861 dyne/cm; (16)Enthalpy of Vaporization: 76.234 kJ/mol; (17)Boiling Point: 471.516 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)SC1Cc2ccc(O)cc2
(2)InChI: InChI=1/C10H9NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-4,8,12H,5H2,(H,11,13,14)
(3)InChIKey: NKOHRVBBQISBSB-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C10H9NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-4,8,12H,5H2,(H,11,13,14)
(5)Std. InChIKey: NKOHRVBBQISBSB-UHFFFAOYSA-N

Product Name

2,4-Thiazolidinedione,5-[(4-hydroxyphenyl)methyl]-

5-(4-Hydroxybenzyl)-1,3-thiazolidine-2,4-dione Specification

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