4-Amino-3-mercaptopyridine supplier

Name
3-Pyridinethiol,4-amino-(6CI,9CI)
EINECS
CAS No. 52334-54-0
Article Data3
CAS DataBase
Density 1.293 g/cm³
Solubility
Melting Point
Formula C₅H₆N₂S
Boiling Point 306.367 °C at 760 mmHg
Molecular Weight 126.18
Flash Point 139.086 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Pyridinethiol,4-amino-(6CI,9CI);3-pyridinethiol, 4-amino-;4-Aminopyridine-3-thiol;
PSA 78.44000
LogP 0.88260

4-Amino-3-mercaptopyridine Specification

The 4-Amino-3-mercaptopyridine, with the CAS registry number 52334-54-0, is also named as 3-pyridinethiol, 4-amino-. It belongs to the product category of Pyridine. Its molecular formula is C₅H₆N₂S and its molecular weight is 126.18. Additionally, its IUPAC name is 4-aminopyridine-3-thiol.

Other characteristics of the 4-Amino-3-mercaptopyridine can be summarised as followings: (1)ACD/LogP: 0.76; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 77.71 Å²; (11)Index of Refraction: 1.677; (12)Molar Refractivity: 36.756 cm³; (13)Molar Volume: 97.548 cm³; (14)Polarizability: 14.571×10^-24cm³; (15)Surface Tension: 63.86 dyne/cm; (16)Density: 1.294 g/cm³; (17)Flash Point: 139.086 °C; (18)Enthalpy of Vaporization: 54.688 kJ/mol; (19)Boiling Point: 306.367 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1ccncc1S
(2)InChI: InChI=1/C5H6N2S/c6-4-1-2-7-3-5(4)8/h1-3,8H,(H2,6,7)
(3)InChIKey: XLWSHDHXYQCBCK-UHFFFAOYAA

Product Name

3-Pyridinethiol,4-amino-(6CI,9CI)

4-Amino-3-mercaptopyridine Specification

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