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858-11-7 | Peroxide, bis(1-oxo-5-phenylpentyl)
CAS No: 858-11-7 Catalog No: AG004OGI MDL No:
Product Description
Catalog Number:
AG004OGI
Chemical Name:
Peroxide, bis(1-oxo-5-phenylpentyl)
CAS Number:
858-11-7
Molecular Formula:
C22H26O4
Molecular Weight:
354.4394
IUPAC Name:
5-phenylpentanoyl 5-phenylpentaneperoxoate
InChI:
InChI=1S/C22H26O4/c23-21(17-9-7-15-19-11-3-1-4-12-19)25-26-22(24)18-10-8-16-20-13-5-2-6-14-20/h1-6,11-14H,7-10,15-18H2
InChI Key:
ROGNYQIKYLHDOS-UHFFFAOYSA-N
SMILES:
O=C(OOC(=O)CCCCc1ccccc1)CCCCc1ccccc1
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.183g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.446g/mol
Monoisotopic Mass:
354.183g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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