CAS No.110199-18-3,(R)-4-PHENYL-1,3-THIAZOLIDINE-2-THIONE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	110199-18-3
Name:	(R)-4-PHENYL-1,3-THIAZOLIDINE-2-THIONE
Article Data:	7

Formula:	C₉H₉NS₂
Molecular Weight:	195.309
Synonyms:	2-Thiazolidinethione,4-phenyl-, (R)-;(R)-4-Phenylthiazolidine-2-thione;
Density:	1.317 g/cm³
Melting Point:	128.0 to 130.0 °C
Boiling Point:	322.2 °C at 760 mmHg
Flash Point:	148.662 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	69.42000
LogP:	2.67780

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Specification

The (R)-4-Phenylthiazolidine-2-thione, with CAS registry number 110199-18-3, has the systematic name of (4R)-4-phenyl-1,3-thiazolidine-2-thione. Besides this, it is also called 2-thiazolidinethione, 4-phenyl-, (4R)-. And the chemical formula of this chemical is C₉H₉NS_2.

Physical properties of (R)-4-Phenylthiazolidine-2-thione: (1)ACD/LogP: 2.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 50; (6)ACD/BCF (pH 7.4): 50; (7)ACD/KOC (pH 5.5): 575; (8)ACD/KOC (pH 7.4): 575; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 69.42 ?2; (13)Index of Refraction: 1.7; (14)Molar Refractivity: 57.356 cm3; (15)Molar Volume: 148.337 cm3; (16)Polarizability: 22.738 10-24cm3; (17)Surface Tension: 64.022 dyne/cm; (18)Enthalpy of Vaporization: 56.403 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The (R)-4-Phenylthiazolidine-2-thione irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: S=C2SC[C@@H](c1ccccc1)N2
(2)InChI: InChI=1/C9H9NS2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11)/t8-/m0/s1
(3)InChIKey: IEXSISKCCADMLK-QMMMGPOBBZ
(4)Std. InChI: InChI=1S/C9H9NS2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11)/t8-/m0/s1
(5)Std. InChIKey: IEXSISKCCADMLK-QMMMGPOBSA-N