2-[(2-methylphenyl)amino]-1,3-thiazol-4-one supplier

Name
2-O-TOLYLAMINO-THIAZOL-4-ONE
EINECS
CAS No. 37394-99-3
Article Data9
CAS DataBase
Density 1.31 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₀N₂OS
Boiling Point 327.8 °C at 760 mmHg
Molecular Weight 206.268
Flash Point 152 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-[(2-methylphenyl)amino]-1,3-thiazol-4(5H)-one;(2E)-2-[(2-Methylphenyl)imino]-1,3-thiazolidin-4-one;2-o-Tolylamino-thiazol-4-one;4(5H)-thiazolone, 2-[(2-methylphenyl)amino]-;4-thiazolidinone, 2-[(2-methylphenyl)imino]-, (2E)-;
PSA 70.25000
LogP 2.12140

2-[(2-methylphenyl)amino]-1,3-thiazol-4-one Specification

The 2-[(2-methylphenyl)amino]-1,3-thiazol-4-one, with the CAS registry number 37394-99-3, is also called 4(5H)-thiazolone, 2-[(2-methylphenyl)amino]-. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₀H₁₀N₂OS.

The characteristics of 2-[(2-methylphenyl)amino]-1,3-thiazol-4-one are as followings: (1)ACD/LogP: 1.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.63; (4)ACD/LogD (pH 7.4): 1.63; (5)ACD/BCF (pH 5.5): 10.28; (6)ACD/BCF (pH 7.4): 10.28; (7)ACD/KOC (pH 5.5): 184.49; (8)ACD/KOC (pH 7.4): 184.51; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 57.97 Å²; (13)Index of Refraction: 1.662; (14)Molar Refractivity: 58.11 cm³; (15)Molar Volume: 156.8 cm³; (16)Polarizability: 23.03×10^-24cm³; (17)Surface Tension: 50.4 dyne/cm; (18)Density: 1.31 g/cm³; (19)Flash Point: 152 °C; (20)Enthalpy of Vaporization: 57.01 kJ/mol; (21)Boiling Point: 327.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000198 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C1\N=C(/SC1)Nc2c(cccc2)C
(2)InChI: InChI=1/C10H10N2OS/c1-7-4-2-3-5-8(7)11-10-12-9(13)6-14-10/h2-5H,6H2,1H3,(H,11,12,13)
(3)InChIKey: ZHBWFKCQBDLFKE-UHFFFAOYAP

Product Name

2-O-TOLYLAMINO-THIAZOL-4-ONE

2-[(2-methylphenyl)amino]-1,3-thiazol-4-one Specification

Related Products

Hot Products