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Molecule structure of 5-Cyano-1-indanone (CAS NO.25724-79-2):
IUPAC Name: 1-Oxo-2,3-dihydroindene-5-carbonitrile
Molecular Weight: 157.16868 [g/mol]
Molecular Formula: C10H7NO
Index of Refraction: 1.596
Molar Refractivity: 43.27 cm3
Molar Volume: 127.1 cm3
Surface Tension: 54.4 dyne/cm
Density: 1.23 g/cm3
Flash Point: 150.7 °C
Enthalpy of Vaporization: 56.77 kJ/mol
Boiling Point: 325.6 °C at 760 mmHg
Vapour Pressure: 0.000228 mmHg at 25 °C
XLogP3-AA: 1.4
H-Bond Acceptor: 2
Tautomer Count: 2
Exact Mass: 157.052764
MonoIsotopic Mass: 157.052764
Topological Polar Surface Area: 40.9
Heavy Atom Count: 12
Canonical SMILES: C1CC(=O)C2=C1C=C(C=C2)C#N
InChI: InChI=1S/C10H7NO/c11-6-7-1-3-9-8(5-7)2-4-10(9)12/h1,3,5H,2,4H2
InChIKey: CAJDYMAFIOUARK-UHFFFAOYSA-N
Product Categories of 5-Cyano-1-indanone (CAS NO.25724-79-2): Building Blocks
5-Cyano-1-indanone (CAS NO.25724-79-2) is also named as 1H-indene-5-carbonitrile, 2,3-dihydro-1-oxo- ; 1-Oxoindan-5-carbonitril ; 1-Oxoindane-5-carbonitrile ; 2,3-Dihydro-1-oxo-1H-indene-5-carbonitrile .