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89061-03-0 | Diazene, bis[1-(phenylmethyl)pentyl]-, 1,2-dioxide
CAS No: 89061-03-0 Catalog No: AG004116 MDL No:
Product Description
Catalog Number:
AG004116
Chemical Name:
Diazene, bis[1-(phenylmethyl)pentyl]-, 1,2-dioxide
CAS Number:
89061-03-0
Molecular Formula:
C24H34N2O2
Molecular Weight:
382.5390
IUPAC Name:
[oxido(1-phenylhexan-2-yl)amino]-oxo-(1-phenylhexan-2-yl)azanium
InChI:
InChI=1S/C24H34N2O2/c1-3-5-17-23(19-21-13-9-7-10-14-21)25(27)26(28)24(18-6-4-2)20-22-15-11-8-12-16-22/h7-16,23-24H,3-6,17-20H2,1-2H3
InChI Key:
BKXPYFJLSUQFTH-UHFFFAOYSA-N
SMILES:
CCCCC([N+](=[N+](C(Cc1ccccc1)CCCC)[O-])[O-])Cc1ccccc1
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.262g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.548g/mol
Monoisotopic Mass:
382.262g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
46.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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