Molecular Structure of 1-(1,1,2,3,3,6-Hexamethyl-2,3-dihydro-1H-inden-5-yl)ethanone (CAS NO.15323-35-0):
IUPAC Name: 1-(1,1,2,3,3,6-Hexamethyl-2H-inden-5-yl)ethanone
Molecular Formula: C17H24O
Molecular Weight: 244.37
EINECS: 239-360-0
XLogP3-AA: 4.8
H-Bond Donor: 0
H-Bond Acceptor: 1
Index of Refraction: 1.494
Molar Refractivity: 76.63 cm3
Molar Volume: 263.1 cm3
Surface Tension: 31.1 dyne/cm
Density: 0.928 g/cm3
Flash Point: 140.5 °C
Enthalpy of Vaporization: 57.98 kJ/mol
Boiling Point: 336.6 °C at 760 mmHg
Vapour Pressure: 0.000111 mmHg at 25 °C
Appearance: off-white crystals or solid
Canonical SMILES: CC1C(C2=C(C1(C)C)C=C(C(=C2)C)C(=O)C)(C)C
InChI: InChI=1S/C17H24O/c1-10-8-14-15(9-13(10)11(2)18)17(6,7)12(3)16(14,4)5/h8-9,12H,1-7H3
InChIKey: VDBHOHJWUDKDRW-UHFFFAOYSA-N
1-(1,1,2,3,3,6-Hexamethyl-2,3-dihydro-1H-inden-5-yl)ethanone (CAS NO.15323-35-0), its Synonyms are 1-(2,3-Dihydro-1,1,2,3,3,6-hexamethyl-1H-inden-5-yl)ethanone ; 6-Acetyl-1,1,2,3,3,5-hexamethyl indan ; Acetyl hexamethyl indan ; Ethanone, 1-(2,3-dihydro-1,1,2,3,3,6-hexamethyl-1H-inden-5-yl)- ; Phantolid ; 5-Acetyl-1,1,2,3,3,6-hexamethylindan ; Phantolide ; Ketone, 1,1,2,3,3,6-hexamethyl-5-indanyl methyl (8CI) .
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