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61149-54-0

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Basic Information
CAS No.: 61149-54-0
Name: 5-Methyl-4-nitroindole
Article Data: 2
Molecular Structure:
Molecular Structure of 61149-54-0 (5-Methyl-4-nitroindole)
Formula: C9H8 N2 O2
Molecular Weight: 176.175
Synonyms: 5-Methyl-4-nitro-1H-indole
Density: 1.355g/cm3
Boiling Point: 361.1°C at 760 mmHg
Flash Point: 172.2°C
PSA: 74.50000
LogP: 2.30270
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Chemistry

Systematic Name: 1H-Indole, 5-methyl-4-nitro-
Synonyms of 5-Methyl-4-nitroindole (CAS NO.61149-54-0): 5-Methyl-4-nitro-1H-indole
CAS NO: 61149-54-0
Molecular Formula: C9H8N2O2
Molecular Weight: 176.17
Molecular Structure:
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 61.61 Å2
Index of Refraction: 1.693
Molar Refractivity: 49.89 cm3
Molar Volume: 129.9 cm3
Surface Tension: 61.3 dyne/cm
Density: 1.355 g/cm3
Flash Point: 172.2 °C
Enthalpy of Vaporization: 58.3 kJ/mol
Boiling Point: 361.1 °C at 760 mmHg
Vapour Pressure: 4.42E-05 mmHg at 25°C
SMILES: [O-][N+](=O)c1c(C)ccc2nccc12
InChI: InChI=1/C9H8N2O2/c1-6-2-3-8-7(4-5-10-8)9(6)11(12)13/h2-5,10H,1H3
InChIKey: YEWCWEGSXBIVEC-UHFFFAOYAO
Std. InChI: InChI=1S/C9H8N2O2/c1-6-2-3-8-7(4-5-10-8)9(6)11(12)13/h2-5,10H,1H3
Std. InChIKey: YEWCWEGSXBIVEC-UHFFFAOYSA-N
Product Categories of 5-Methyl-4-nitroindole (CAS NO.61149-54-0): Indole