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13248-12-9 | 1H-Indene-1,3(2H)-dione, 2-(diphenylmethylene)-
CAS No: 13248-12-9 Catalog No: AG0010R1 MDL No:
Product Description
Catalog Number:
AG0010R1
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(diphenylmethylene)-
CAS Number:
13248-12-9
Molecular Formula:
C22H14O2
Molecular Weight:
310.3454
IUPAC Name:
2-benzhydrylideneindene-1,3-dione
InChI:
InChI=1S/C22H14O2/c23-21-17-13-7-8-14-18(17)22(24)20(21)19(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChI Key:
DABOCHPSTHGYLH-UHFFFAOYSA-N
SMILES:
O=C1C(=C(c2ccccc2)c2ccccc2)C(=O)c2c1cccc2
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.099g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.352g/mol
Monoisotopic Mass:
310.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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