Thiazole,2-methyl-5-nitro- supplier

Name
2-Methyl-5-nitrothiazole
EINECS
CAS No. 16243-71-3
Article Data5
CAS DataBase
Density 1.437 g/cm³
Solubility
Melting Point 131-133 °C
Formula C₄H₄N₂O₂S
Boiling Point 242.9 °C at 760 mmHg
Molecular Weight 144.154
Flash Point 100.7 °C
Transport Information
Appearance Pale yellow clear liquid
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Methyl-5-nitrothiazole;2-Methyl-5-nitro-1,3-thiazole;
PSA 86.95000
LogP 1.88290

Thiazole,2-methyl-5-nitro- Specification

The Thiazole,2-methyl-5-nitro-, with the CAS registry number 16243-71-3, is also known 2-Methyl-5-nitrothiazole. It belongs to the product category of Thiazoles. This chemical's molecular formula is C₄H₄N₂O₂S and molecular weight is 144.15. What's more, its systematic name is 2-Methyl-5-nitro-1,3-thiazole.

Physical properties of Thiazole,2-methyl-5-nitro- are: (1)ACD/LogP: 0.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.83; (4)ACD/LogD (pH 7.4): 0.83; (5)ACD/BCF (pH 5.5): 2.52; (6)ACD/BCF (pH 7.4): 2.52; (7)ACD/KOC (pH 5.5): 67.52; (8)ACD/KOC (pH 7.4): 67.52; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 86.95 Å²; (13)Index of Refraction: 1.595; (14)Molar Refractivity: 34.09 cm³; (15)Molar Volume: 100.2 cm³; (16)Polarizability: 13.51×10^-24 cm³; (17)Surface Tension: 58.8 dyne/cm; (18)Density: 1.437 g/cm³; (19)Flash Point: 100.7 °C; (20)Enthalpy of Vaporization: 46.05 kJ/mol; (21)Boiling Point: 242.9 °C at 760 mmHg; (22)Vapour Pressure: 0.0515 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1sc(nc1)C
(2)InChI: InChI=1/C4H4N2O2S/c1-3-5-2-4(9-3)6(7)8/h2H,1H3
(3)InChIKey: YIFARGVNPMLZTQ-UHFFFAOYAL

Product Name

2-Methyl-5-nitrothiazole

Thiazole,2-methyl-5-nitro- Specification

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