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2587-42-0 | 4,4-BIS(N-HEXYLOXY)AZOXYBENZENE
CAS No: 2587-42-0 Catalog No: AG003KEG MDL No:MFCD00043672
Product Description
Catalog Number:
AG003KEG
Chemical Name:
4,4-BIS(N-HEXYLOXY)AZOXYBENZENE
CAS Number:
2587-42-0
Molecular Formula:
C24H34N2O3
Molecular Weight:
398.5384
MDL Number:
MFCD00043672
IUPAC Name:
(4-hexoxyphenyl)-(4-hexoxyphenyl)imino-oxidoazanium
InChI:
InChI=1S/C24H34N2O3/c1-3-5-7-9-19-28-23-15-11-21(12-16-23)25-26(27)22-13-17-24(18-14-22)29-20-10-8-6-4-2/h11-18H,3-10,19-20H2,1-2H3
InChI Key:
GWRSINRMEBHRIO-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc(cc1)/N=[N+](/c1ccc(cc1)OCCCCCC)\[O-]
NSC Number:
127558
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
398.257g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
398.547g/mol
Monoisotopic Mass:
398.257g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.8
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