Molecular Structure of 4-Nitroindanone (CAS NO.24623-25-4):
IUPAC Name: 4-Nitro-2,3-dihydroinden-1-one
Canonical SMILES: C1CC(=O)C2=C1C(=CC=C2)[N+](=O)[O-]
InChI: InChI=1S/C9H7NO3/c11-9-5-4-6-7(9)2-1-3-8(6)10(12)13/h1-3H,4-5H2
InChIKey: QIIWEVWPOBNGLP-UHFFFAOYSA-N
Molecular Weight: 177.15678 [g/mol]
Molecular Formula: C9H7NO3
XLogP3-AA: 1.5
H-Bond Donor: 0
H-Bond Acceptor: 3
EINECS: 246-367-2
Product Categories: Indanone & Indene
Index of Refraction: 1.629
Molar Refractivity: 45.1 cm3
Molar Volume: 126.8 cm3
Surface Tension: 61.1 dyne/cm
Density: 1.396 g/cm3
Flash Point: 170.4 °C
Enthalpy of Vaporization: 57.57 kJ/mol
Boiling Point: 332.9 °C at 760 mmHg
Vapour Pressure: 0.000141 mmHg at 25 °C
4-Nitroindanone (CAS NO.24623-25-4), its Synonyms are 4-Nitroindan-1-one ; 4-Nitro-1-Indanone ; 4-Nitro-2,3-dihydro-1H-inden-1-one ; 2,3-Dihydro-4-nitroinden-1-one ; 1H-Inden-1-one, 2,3-dihydro-4-nitro- .
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