5-(4-Chlorophenyl)-2-thiazolamine supplier

Name
2-Amino-5-(4-chlorophenyl)thiazole
EINECS
CAS No. 73040-66-1
Article Data4
CAS DataBase
Density 1.389 g/cm³
Solubility
Melting Point 203-204 °C
Formula C₉H₇ClN₂S
Boiling Point 389.8 °C at 760 mmHg
Molecular Weight 210.687
Flash Point 189.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-5-(4-chlorophenyl)thiazole;
PSA 67.88000
LogP 2.97580

5-(4-Chlorophenyl)-2-thiazolamine Specification

The Systematic name of 5-(4-Chlorophenyl)-2-thiazolamine is 4-(4-chlorophenyl)-1,3-thiazol-2-amine. With the CAS registry number 73040-66-1, it is also named as 2-Amino-5-(4-chlorophenyl)thiazole. The product's Molecular Formula is C₉H₇ClN₂S and its Molecular Weight is 210.68.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 2.71 ; (2) # of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): 2.65 ; (4) ACD/LogD (pH 7.4): 2.71 ; (5)ACD/BCF (pH 5.5): 58.62 ; (6) ACD/BCF (pH 7.4): 67.14 ; (7)ACD/KOC (pH 5.5): 616.89 ; (8) ACD/KOC (pH 7.4): 706.5 ; (9)H bond acceptors: 2 ; (10) H bond donors: 2 ; (11) Freely Rotating Bonds: 1 ; (12) Polar Surface Area: 44.37 Å² ; (13) Index of Refraction: 1.667 ; (14) Molar Refractivity: 56.45 cm³ ; (15)Molar Volume: 151.6 cm³ ; (16) Polarizability: 22.37×10^-24cm³ ; (17) Surface Tension: 58.6 dyne/cm ; (18) Density: 1.389 g/cm³ ; (19) Flash Point: 189.6 °C ; (20) Enthalpy of Vaporization: 63.92 kJ/mol ; (21) Boiling Point: 389.8 °C at 760 mmHg ; (22) Vapour Pressure: 2.77E-06 mmHg at 25 °C ; (23) Melting point: 203-204 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:Clc2ccc(c1nc(sc1)N)cc2;
(2)InChI:InChI=1/C9H7ClN2S/c10-7-3-1-6(2-4-7)8-5-13-9(11)12-8/h1-5H,(H2,11,12);
(3)InChIKey:DWGWNNCHJPKZNC-UHFFFAOYAJ;
(4)Std. InChI:InChI=1S/C9H7ClN2S/c10-7-3-1-6(2-4-7)8-5-13-9(11)12-8/h1-5H,(H2,11,12);
(5)Std. InChIKey:DWGWNNCHJPKZNC-UHFFFAOYSA-N.

Product Name

2-Amino-5-(4-chlorophenyl)thiazole

5-(4-Chlorophenyl)-2-thiazolamine Specification

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