2(3H)-Thiazolethione,3,4-dimethyl- supplier

Name
3,4-Dimethyl-4-thiazoline-2-thione
EINECS
CAS No. 5316-79-0
Article Data12
CAS DataBase
Density 1.29 g/cm³
Solubility
Melting Point
Formula C₅H₇NS₂
Boiling Point 205.6 °C at 760 mmHg
Molecular Weight 145.249
Flash Point 78.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Thiazoline-2-thione,3,4-dimethyl- (6CI,7CI,8CI);3,4-Dimethyl-4-thiazoline-2-thione;NSC 306416;3,4-Dimethylthiazoline-2-thione;
PSA 65.26000
LogP 2.12450

2(3H)-Thiazolethione,3,4-dimethyl- Specification

This chemical is called 2(3H)-Thiazolethione,3,4-dimethyl-, and its IUPAC name is 3,4-dimethyl-1,3-thiazole-2-thione. With the molecular formula of C₅H₇NS₂, its molecular weight is 145.25. The CAS registry number of this chemical is 5316-79-0.

Other characteristics of the 2(3H)-Thiazolethione,3,4-dimethyl- can be summarised as followings: (1)ACD/LogP: 1.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.25; (4)ACD/LogD (pH 7.4): 1.25; (5)ACD/BCF (pH 5.5): 5.22; (6)ACD/BCF (pH 7.4): 5.22; (7)ACD/KOC (pH 5.5): 113.54; (8)ACD/KOC (pH 7.4): 113.54; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 60.63 Å²; (13)Index of Refraction: 1.672; (14)Molar Refractivity: 41.83 cm³; (15)Molar Volume: 111.7 cm³; (16)Polarizability: 16.58×10^-24cm³; (17)Surface Tension: 59.1 dyne/cm; (18)Density: 1.29 g/cm³; (19)Flash Point: 78.1 °C; (20)Enthalpy of Vaporization: 44.18 kJ/mol; (21)Boiling Point: 205.6 °C at 760 mmHg; (22)Vapour Pressure: 0.248 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: S=C1S\C=C(/N1C)C
2.InChI: InChI=1/C5H7NS2/c1-4-3-8-5(7)6(4)2/h3H,1-2H3
3.InChIKey: YLEWVHJVGDKCNJ-UHFFFAOYAT

Product Name

3,4-Dimethyl-4-thiazoline-2-thione

2(3H)-Thiazolethione,3,4-dimethyl- Specification

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