5-Thiazolecarboxamide supplier

Name
thiazole-5-carboxamide
EINECS 277-861-6
CAS No. 74411-19-1
Article Data3
CAS DataBase
Density 1.41 g/cm³
Solubility
Melting Point 196 °C
Formula C₄H₄N₂OS
Boiling Point 365.2 °C at 760 mmHg
Molecular Weight 128.155
Flash Point 174.7 °C
Transport Information
Appearance
Safety 26
Risk Codes 36
Molecular Structure
Hazard Symbols
Synonyms Thiazole-5-carboxamide;
PSA 84.22000
LogP 0.94230

5-Thiazolecarboxamide Specification

The IUPAC name of 5-Thiazolecarboxamide is 1,3-thiazole-5-carboxamide. With the CAS registry number 74411-19-1, it is also named as Thiazole-5-carboxamide. The product's categories are Building Blocks; Thiazole. In addition, its molecular formula is C₄H₄N₂OS and molecular weight is 128.15236.

The other characteristics of 5-Thiazolecarboxamide can be summarized as: (1)EINECS: 277-861-6; (2)ACD/LogP: -1.04; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): -1.04; (5)ACD/LogD (pH 7.4): -1.04; (6)ACD/BCF (pH 5.5): 1; (7)ACD/BCF (pH 7.4): 1; (8)ACD/KOC (pH 5.5): 6.49; (9)ACD/KOC (pH 7.4): 6.49; (10)#H bond acceptors: 3; (11)#H bond donors: 2; (12)#Freely Rotating Bonds: 1; (13)Polar Surface Area: 61.44 Å²; (14)Index of Refraction: 1.613; (15)Molar Refractivity: 31.65 cm³; (16)Molar Volume: 90.8 cm³; (17)Polarizability: 12.55×10^-24cm³; (18)Surface Tension: 66.1 dyne/cm; (19)Density: 1.41 g/cm³; (20)Flash Point: 174.7 °C; (21)Enthalpy of Vaporization: 61.15 kJ/mol; (22)Boiling Point: 365.2 °C at 760 mmHg; (23)Vapour Pressure: 1.59E-05 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)Canonical SMILES: C1=C(SC=N1)C(=O)N
(2)InChI: InChI=1S/C4H4N2OS/c5-4(7)3-1-6-2-8-3/h1-2H,(H2,5,7)
(3)InChIKey: GGNIKGLUPSHSBV-UHFFFAOYSA-N

Product Name

thiazole-5-carboxamide

5-Thiazolecarboxamide Specification

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