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82929-01-9 | 1H-Indene-1,3(2H)-dione, 2-[1,1'-biphenyl]-4-yl-2-pentyl-
CAS No: 82929-01-9 Catalog No: AG00549N MDL No:
Product Description
Catalog Number:
AG00549N
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-[1,1'-biphenyl]-4-yl-2-pentyl-
CAS Number:
82929-01-9
Molecular Formula:
C26H24O2
Molecular Weight:
368.4676
IUPAC Name:
2-pentyl-2-(4-phenylphenyl)indene-1,3-dione
InChI:
InChI=1S/C26H24O2/c1-2-3-9-18-26(24(27)22-12-7-8-13-23(22)25(26)28)21-16-14-20(15-17-21)19-10-5-4-6-11-19/h4-8,10-17H,2-3,9,18H2,1H3
InChI Key:
QDKWJZKMFIWCAG-UHFFFAOYSA-N
SMILES:
CCCCCC1(c2ccc(cc2)c2ccccc2)C(=O)c2c(C1=O)cccc2
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.178g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.476g/mol
Monoisotopic Mass:
368.178g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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