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139386-95-1 | 1H-Inden-1-one, 2,3-dihydro-2-(3-oxo-1,3-diphenylpropyl)-
CAS No: 139386-95-1 Catalog No: AG001AX7 MDL No:
Product Description
Catalog Number:
AG001AX7
Chemical Name:
1H-Inden-1-one, 2,3-dihydro-2-(3-oxo-1,3-diphenylpropyl)-
CAS Number:
139386-95-1
Molecular Formula:
C24H20O2
Molecular Weight:
340.4144
IUPAC Name:
2-(3-oxo-1,3-diphenylpropyl)-2,3-dihydroinden-1-one
InChI:
InChI=1S/C24H20O2/c25-23(18-11-5-2-6-12-18)16-21(17-9-3-1-4-10-17)22-15-19-13-7-8-14-20(19)24(22)26/h1-14,21-22H,15-16H2
InChI Key:
ZMBWRDLBWILLRJ-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CC(C1Cc2c(C1=O)cccc2)c1ccccc1
Properties
Complexity:
498
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.146g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.422g/mol
Monoisotopic Mass:
340.146g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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