2-(Pyridin-4-yl)benzo[d]thiazole supplier

Name
2-(Pyridin-4-yl)benzo[d]thiazole
EINECS
CAS No. 2295-38-7
Article Data4
CAS DataBase
Density 1.288 g/cm³
Solubility
Melting Point
Formula C₁₂H₈N₂S
Boiling Point 393 °C at 760 mmHg
Molecular Weight 212.275
Flash Point 188.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Pyridin-4-ylbenzothiazole;
PSA 54.02000
LogP 3.35830

2-(Pyridin-4-yl)benzo[d]thiazole Specification

The 2-(Pyridin-4-yl)benzo[d]thiazole, with the CAS registry number 2295-38-7, is also known as Benzothiazole and 2-(4-Pyridyl)-1,3-benzothiazole. It belongs to the product category of Benzothiazole. This chemical's molecular formula is C₁₂H₈N₂S and molecular weight is 212.27. Its IUPAC name is called 2-pyridin-4-yl-1,3-benzothiazole.

Physical properties of this chemical are as follows: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Index of Refraction: 1.693; (7)Molar Refractivity: 63.25 cm³; (8)Molar Volume: 164.7 cm³; (9)Surface Tension: 58.6 dyne/cm; (10)Density: 1.288 g/cm³; (11)Flash Point: 188.4 °C; (12)Enthalpy of Vaporization: 61.77 kJ/mol; (13)Boiling Point: 393 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c3ccccc3sc1c2ccncc2
(2)InChI: InChI=1/C12H8N2S/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H
(3)InChIKey: PDSIQRUYAXGTJG-UHFFFAOYAH

Product Name

2-(Pyridin-4-yl)benzo[d]thiazole

2-(Pyridin-4-yl)benzo[d]thiazole Specification

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