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14065-33-9 | 1,10-Decanedione, 1,10-bis(4-methylphenyl)-
CAS No: 14065-33-9 Catalog No: AG001CNE MDL No:
Product Description
Catalog Number:
AG001CNE
Chemical Name:
1,10-Decanedione, 1,10-bis(4-methylphenyl)-
CAS Number:
14065-33-9
Molecular Formula:
C24H30O2
Molecular Weight:
350.4938
IUPAC Name:
1,10-bis(4-methylphenyl)decane-1,10-dione
InChI:
InChI=1S/C24H30O2/c1-19-11-15-21(16-12-19)23(25)9-7-5-3-4-6-8-10-24(26)22-17-13-20(2)14-18-22/h11-18H,3-10H2,1-2H3
InChI Key:
YRSDJIWALCOOJS-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C)CCCCCCCCC(=O)c1ccc(cc1)C
NSC Number:
132301
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.225g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.502g/mol
Monoisotopic Mass:
350.225g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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