1H-Benzimidazole,2-(2-thiazolyl)- supplier

Name
2-(1,3-thiazol-2-yl)-1H-benzimidazole
EINECS
CAS No. 3574-94-5
Article Data8
CAS DataBase
Density 1.406 g/cm³
Solubility
Melting Point
Formula C₁₀H₇N₃S
Boiling Point 435.6 °C at 760 mmHg
Molecular Weight 201.25
Flash Point 219.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzimidazole,2-(2-thiazolyl)- (7CI,8CI);2-(1H-Benzimidazol-2-yl)-1,3-thiazole;2-(1,3-Thiazol-2-yl)-1H-benzimidazole;2-(2-Thiazolyl)benzimidazole;Benzimidazole, 2-(2-thiazolyl)-;
PSA
LogP

1H-Benzimidazole,2-(2-thiazolyl)- Specification

The 1H-Benzimidazole,2-(2-thiazolyl)-, with the CAS registry number 3574-94-5, is also known as 2-(1,3-Thiazol-2-yl)-1H-benzimidazole. This chemical's molecular formula is C₁₀H₇N₃S and molecular weight is 201.25. What's more, its IUPAC name is 2-(1H-benzimidazol-2-yl)-1,3-thiazole.

Physical properties of 1H-Benzimidazole,2-(2-thiazolyl)- are: (1)ACD/LogP: 2.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.93; (4)ACD/LogD (pH 7.4): 2.93; (5)ACD/BCF (pH 5.5): 97.99; (6)ACD/BCF (pH 7.4): 99.69; (7)ACD/KOC (pH 5.5): 921.98; (8)ACD/KOC (pH 7.4): 937.96; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 58.95 Å²; (13)Index of Refraction: 1.739; (14)Molar Refractivity: 57.68 cm³; (15)Molar Volume: 143 cm³; (16)Polarizability: 22.86×10^-24cm³; (17)Surface Tension: 71.1 dyne/cm; (18)Density: 1.406 g/cm³; (19)Flash Point: 219.5 °C; (20)Enthalpy of Vaporization: 69.19 kJ/mol; (21)Boiling Point: 435.6 °C at 760 mmHg; (22)Vapour Pressure: 8.63E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)NC(=N2)C3=NC=CS3
(2)InChI: InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-9(13-8)10-11-5-6-14-10/h1-6H,(H,12,13)
(3)InChIKey: JBAITADHMBPOQQ-UHFFFAOYSA-N

Product Name

2-(1,3-thiazol-2-yl)-1H-benzimidazole

1H-Benzimidazole,2-(2-thiazolyl)- Specification

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