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117135-59-8 | Diazene, 1-butyl-2-(1-hydroperoxy-1-methylethyl)-
CAS No: 117135-59-8 Catalog No: AG000DRS MDL No:
Product Description
Catalog Number:
AG000DRS
Chemical Name:
Diazene, 1-butyl-2-(1-hydroperoxy-1-methylethyl)-
CAS Number:
117135-59-8
Molecular Formula:
C7H16N2O2
Molecular Weight:
160.2141
IUPAC Name:
butyl(2-hydroperoxypropan-2-yl)diazene
InChI:
InChI=1S/C7H16N2O2/c1-4-5-6-8-9-7(2,3)11-10/h10H,4-6H2,1-3H3
InChI Key:
OBCIJGSAPVQGBS-UHFFFAOYSA-N
SMILES:
CCCCN=NC(OO)(C)C
UNII:
66N07OW954
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.121g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
160.217g/mol
Monoisotopic Mass:
160.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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