2-Thiazolemethanamine, 4-phenyl- supplier

Name
C-(4-PHENYL-THIAZOL-2-YL)-METHYLAMINE
EINECS 604-604-1
CAS No. 90916-45-3
Article Data3
CAS DataBase
Density 1.208 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₀N₂S
Boiling Point 335.1 °C at 760 mmHg
Molecular Weight 190.269
Flash Point 156.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Thiazole,2-(aminomethyl)-4-phenyl- (7CI);[(4-Phenyl-1,3-thiazol-2-yl)methyl]amine;
PSA 67.15000
LogP 2.96910

2-Thiazolemethanamine, 4-phenyl- Specification

This chemical is called 2-Thiazolemethanamine, 4-phenyl-, and its systematic name is 1-(4-phenyl-1,3-thiazol-2-yl)methanamine. With the molecular formula of C₁₀H₁₀N₂S, its molecular weight is 190.26. The CAS registry number of this chemical is 90916-45-3.

Other characteristics of the 2-Thiazolemethanamine, 4-phenyl- can be summarised as followings: (1)ACD/LogP: 2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.38; (4)ACD/LogD (pH 7.4): 1.88; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 14; (7)ACD/KOC (pH 5.5): 6.13; (8)ACD/KOC (pH 7.4): 197.5; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 44.37 Å²; (13)Index of Refraction: 1.626; (14)Molar Refractivity: 55.77 cm³; (15)Molar Volume: 157.4 cm³; (16)Polarizability: 22.1×10^-24cm³; (17)Surface Tension: 52.5 dyne/cm; (18)Density: 1.208 g/cm³; (19)Flash Point: 156.5 °C; (20)Enthalpy of Vaporization: 57.81 kJ/mol; (21)Boiling Point: 335.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000123 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: n2c(c1ccccc1)csc2CN
2.InChI: InChI=1/C10H10N2S/c11-6-10-12-9(7-13-10)8-4-2-1-3-5-8/h1-5,7H,6,11H2
3.InChIKey: AFSCUDNEJWEMEA-UHFFFAOYAB

Product Name

C-(4-PHENYL-THIAZOL-2-YL)-METHYLAMINE

2-Thiazolemethanamine, 4-phenyl- Specification

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