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Basic Information
CAS No.: 38829-39-9
Name: 3-Methyl-2-nitrofuran
Molecular Structure:
Molecular Structure of 38829-39-9 (3-Methyl-2-nitrofuran)
Formula: C5H5 N O3
Molecular Weight: 127.1
Synonyms: 3-Methyl-2-nitrofuran
Density: 1.266g/cm3
Boiling Point: 176.3°C at 760 mmHg
Flash Point: 60.4°C
PSA: 58.96000
LogP: 2.01940
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Chemistry

Molecular Structure of 3-Methyl-2-nitrofuran (CAS NO.38829-39-9):

Systematic Name: 3-Methyl-2-nitrofuran
SMILES: [O-][N+](=O)c1occc1C
InChI: InChI=1/C5H5NO3/c1-4-2-3-9-5(4)6(7)8/h2-3H,1H3
InChIKey: WVEBQLYBLXZPNF-UHFFFAOYAV 
Empirical Formula: C5H5NO3
Molecular Weight: 127.0981
Nominal Mass: 127
Average Mass: 127.0981
Monoisotopic Mass: 127.026943 
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 1
Index of Refraction: 1.508
Molar Refractivity: 29.92 cm3
Molar Volume: 100.3 cm3
Surface Tension: 41.3 dyne/cm
Density: 1.266 g/cm3
Flash Point: 60.4 °C
Enthalpy of Vaporization: 39.57 kJ/mol
Boiling Point: 176.3 °C at 760 mmHg
Vapour Pressure: 1.48 mmHg at 25 °C
Product Categories: Furans

Specification

 3-Methyl-2-nitrofuran (CAS NO.38829-39-9), its Synonym is Furan,3-methyl-2-nitro- .