5-Thiazolecarbonitrile,2,4-dichloro- supplier

Name
2,4-DICHLORO-5-CYANOTHIAZOLE
EINECS
CAS No. 82554-18-5
Density 1.7 g/cm³
Solubility
Melting Point
Formula C₄Cl₂N₂S
Boiling Point 339.1 °C at 760 mmHg
Molecular Weight 179.029
Flash Point 158.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,4-Dichloro-5-cyanothiazole;
PSA 64.92000
LogP 2.32158

5-Thiazolecarbonitrile,2,4-dichloro- Specification

The CAS registry number of 5-Thiazolecarbonitrile,2,4-dichloro- is 82554-18-5. It belongs to the product categories of Building Blocks; Thiazole. This chemical is also known as 2,4-Dichloro-5-cyanothiazole. The molecular formula of it is C₄Cl₂N₂S and molecular weight is 179.0272. Its systematic name is called 2,4-dichloro-1,3-thiazole-5-carbonitrile.

Physical properties about 5-Thiazolecarbonitrile,2,4-dichloro- are: (1)ACD/LogP: 0.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.99; (4)ACD/LogD (pH 7.4): 0.99; (5)ACD/BCF (pH 5.5): 3.31; (6)ACD/BCF (pH 7.4): 3.31; (7)ACD/KOC (pH 5.5): 82.04; (8)ACD/KOC (pH 7.4): 82.04; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.618; (13)Molar Refractivity: 36.91 cm³; (14)Molar Volume: 105.2 cm³; (15)Surface Tension: 73 dyne/cm; (16)Density: 1.7 g/cm³; (17)Flash Point: 158.9 °C; (18)Enthalpy of Vaporization: 58.26 kJ/mol; (19)Boiling Point: 339.1 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1sc(Cl)nc1Cl
(2)InChI: InChI=1/C4Cl2N2S/c5-3-2(1-7)9-4(6)8-3
(3)InChIKey: HXWDCGDBOAECIP-UHFFFAOYAX

Product Name

2,4-DICHLORO-5-CYANOTHIAZOLE

5-Thiazolecarbonitrile,2,4-dichloro- Specification

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