1H-Benzotriazole, 1,1'-carbonylbis-


Chemical Name: 1H-Benzotriazole, 1,1'-carbonylbis-
CAS Number: 68985-05-7
Product Number: AG00FFAP(AGN-PC-0L9Z2Q)
Synonyms:
MDL No:
Molecular Formula: C13H8N6O
Molecular Weight: 264.24222

Identification/Properties


Computed Properties
Molecular Weight:
264.248g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
264.076g/mol
Monoisotopic Mass:
264.076g/mol
Topological Polar Surface Area:
78.5A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
357
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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