2-Amino-4-(3-pyridyl)thiazole supplier

Name
4-PYRIDIN-3-YL-THIAZOL-2-YLAMINE
EINECS
CAS No. 30235-27-9
Article Data20
CAS DataBase
Density 1.333 g/cm³
Solubility
Melting Point 213 °C(Solv: ethanol (64-17-5))
Formula C₈H₇N₃S
Boiling Point 396.3 °C at 760 mmHg
Molecular Weight 177.23
Flash Point 193.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Pyridine,3-(2-amino-4-thiazolyl)- (8CI);2-Amino-4-(3-pyridyl)thiazole;3-(2-Aminothiazol-4-yl)pyridine;4-(3-Pyridyl)-1,3-thiazol-2-amine;4-(3-Pyridyl)-2-thiazolamine;4-(Pyridin-3-yl)-2-amino-1,3-thiazole;[4-(Pyridin-3-yl)thiazol-2-yl]amine;2-Thiazolamine, 4-(3-pyridinyl)-;4-(Pyridin-3-yl)-1,3-thiazol-2-amine;
PSA 80.04000
LogP 2.36850

2-Amino-4-(3-pyridyl)thiazole Specification

The 2-Thiazolamine,4-(3-pyridinyl)-, with the CAS registry number 30235-27-9, has the systematic name of 4-(pyridin-3-yl)-1,3-thiazol-2-amine. It is also called 4-pyridin-3-yl-1,3-thiazol-2-amine. And the molecular formula of the chemical is C₈H₇N₃S.

The characteristics of 2-Thiazolamine,4-(3-pyridinyl)- are as followings: (1)ACD/LogP: 0.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.8; (4)ACD/LogD (pH 7.4): 0.82; (5)ACD/BCF (pH 5.5): 2.38; (6)ACD/BCF (pH 7.4): 2.48; (7)ACD/KOC (pH 5.5): 63.91; (8)ACD/KOC (pH 7.4): 66.64; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 57.26 Å²; (13)Index of Refraction: 1.669; (14)Molar Refractivity: 49.64 cm³; (15)Molar Volume: 132.9 cm³; (16)Polarizability: 19.68×10^-24cm³; (17)Surface Tension: 65.3 dyne/cm; (18)Density: 1.333 g/cm³; (19)Flash Point: 193.5 °C; (20)Enthalpy of Vaporization: 64.66 kJ/mol; (21)Boiling Point: 396.3 °C at 760 mmHg; (22)Vapour Pressure: 1.72E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: n2cc(c1nc(sc1)N)ccc2
(2)InChI: InChI=1/C8H7N3S/c9-8-11-7(5-12-8)6-2-1-3-10-4-6/h1-5H,(H2,9,11)
(3)InChIKey: XOHZQGAYUHOJPR-UHFFFAOYAU

Product Name

4-PYRIDIN-3-YL-THIAZOL-2-YLAMINE

2-Amino-4-(3-pyridyl)thiazole Specification

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