CAS No.383142-59-4,4-(3-chlorophenyl)-2-thiazolecarboxaldehyde Suppliers

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Basic Information

Molecular Structure:
CAS No.:	383142-59-4
Name:	4-(3-chlorophenyl)-2-thiazolecarboxaldehyde

Formula:	C₁₀H₆ClNOS
Molecular Weight:	223.68
Synonyms:	4-(3-Chlorophenyl)-1,3-thiazole-2-carbaldehyde;4-(3-Chlorophenyl)-2-thiazolecarboxaldehyde;
Density:	1.389 g/cm³
Boiling Point:	396.145 °C at 760 mmHg
Flash Point:	193.382 °C
PSA:	58.20000
LogP:	3.27600

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Specification

The 4-(3-Chlorophenyl)-2-thiazolecarboxaldehyde, with the CAS registry number 383142-59-4, is also known as 2-Thiazolecarboxaldehyde, 4-(3-Chlorophenyl)-. This chemical's molecular formula is C₁₀H₆ClNOS and molecular weight is 223.68. What's more, its systematic name is 4-(3-Chlorophenyl)-1,3-thiazole-2-carbaldehyde.

Physical properties of 4-(3-Chlorophenyl)-2-thiazolecarboxaldehyde are: (1)ACD/LogP: 2.826; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.83; (4)ACD/LogD (pH 7.4): 2.83; (5)ACD/BCF (pH 5.5): 82.72; (6)ACD/BCF (pH 7.4): 82.72; (7)ACD/KOC (pH 5.5): 820.82; (8)ACD/KOC (pH 7.4): 820.82; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 58.2 Å²; (13)Index of Refraction: 1.653; (14)Molar Refractivity: 58.968 cm³; (15)Molar Volume: 161.038 cm³; (16)Polarizability: 23.377×10^-24cm³; (17)Surface Tension: 55.2 dyne/cm; (18)Density: 1.389 g/cm³; (19)Flash Point: 193.382 °C; (20)Enthalpy of Vaporization: 62.119 kJ/mol; (21)Boiling Point: 396.145 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2nc(c1cc(Cl)ccc1)cs2
(2)Std. InChI: InChI=1S/C10H6ClNOS/c11-8-3-1-2-7(4-8)9-6-14-10(5-13)12-9/h1-6H
(3)Std. InChIKey: KKWAXZXIWIXSRB-UHFFFAOYSA-N