4-Aminothiazole supplier | CasNO.17720-99-9

Name
thiazol-4-amine
EINECS
CAS No. 17720-99-9
Article Data2
CAS DataBase
Density 1.345 g/cm³
Solubility
Melting Point
Formula C₃H₄N₂S
Boiling Point 239.313 °C at 760 mmHg
Molecular Weight 100.144
Flash Point 98.533 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Thiazole,4-amino- (8CI);4-Aminothiazole;
PSA 67.15000
LogP 1.30650

4-Aminothiazole Specification

The 4-Aminothiazole, with CAS registry number 17720-99-9, has the systematic name of 1,3-thiazol-4-amine. Besides this, it is also called thiazol-4-amine. And the chemical formula of this chemical is C₃H₄N₂S. Its molecular weight is 100.14.

Physical properties of 4-Aminothiazole: (1)ACD/LogP: 0.30; (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): 5; (6)ACD/KOC (pH 7.4): 8; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 67.15 Å²; (11)Index of Refraction: 1.645; (12)Molar Refractivity: 26.965 cm³; (13)Molar Volume: 74.417 cm³; (14)Polarizability: 10.69×10^-24cm³; (15)Surface Tension: 63.918 dyne/cm; (16)Enthalpy of Vaporization: 47.62 kJ/mol; (17)Vapour Pressure: 0.04 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1cscn1
(2)InChI: InChI=1/C3H4N2S/c4-3-1-6-2-5-3/h1-2H,4H2
(3)InChIKey: QHHHLHCCVDMOJI-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C3H4N2S/c4-3-1-6-2-5-3/h1-2H,4H2
(5)Std. InChIKey: QHHHLHCCVDMOJI-UHFFFAOYSA-N

Product Name

thiazol-4-amine

4-Aminothiazole Specification

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