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116577-32-3 | Peroxide, benzoyl 1-oxo-10-undecenyl (9CI)
CAS No: 116577-32-3 Catalog No: AG000CSP MDL No:
Product Description
Catalog Number:
AG000CSP
Chemical Name:
Peroxide, benzoyl 1-oxo-10-undecenyl (9CI)
CAS Number:
116577-32-3
Molecular Formula:
C18H24O4
Molecular Weight:
304.3808
IUPAC Name:
undec-10-enoyl benzenecarboperoxoate
InChI:
InChI=1S/C18H24O4/c1-2-3-4-5-6-7-8-12-15-17(19)21-22-18(20)16-13-10-9-11-14-16/h2,9-11,13-14H,1,3-8,12,15H2
InChI Key:
UPMYPJGSCUKJJG-UHFFFAOYSA-N
SMILES:
C=CCCCCCCCCC(=O)OOC(=O)c1ccccc1
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.167g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.386g/mol
Monoisotopic Mass:
304.167g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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