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137887-32-2

137887-32-2 | Diazene, 1-(1,1-dimethylethyl)-2-(2-nitrophenyl)-, 2-oxide

CAS No: 137887-32-2 Catalog No: AG001417 MDL No:

Product Description

Catalog Number:
AG001417
Chemical Name:
Diazene, 1-(1,1-dimethylethyl)-2-(2-nitrophenyl)-, 2-oxide
CAS Number:
137887-32-2
Molecular Formula:
C10H13N3O3
Molecular Weight:
223.2285
IUPAC Name:
tert-butyl-(2-nitrophenyl)imino-oxidoazanium
InChI:
InChI=1S/C10H13N3O3/c1-10(2,3)13(16)11-8-6-4-5-7-9(8)12(14)15/h4-7H,1-3H3
InChI Key:
UTFFBMJPIFGAFS-UHFFFAOYSA-N
SMILES:
[O-][N+](=NC(C)(C)C)c1ccccc1[N+](=O)[O-]

Properties

Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.096g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.232g/mol
Monoisotopic Mass:
223.096g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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