4H-1-Benzopyran-4-one, 8-amino-2-(1H-tetrazol-5-yl)-


Chemical Name: 4H-1-Benzopyran-4-one, 8-amino-2-(1H-tetrazol-5-yl)-
CAS Number: 110683-22-2
Product Number: AG007UOB(AGN-PC-0NXFXS)
Synonyms:
MDL No:
Molecular Formula: C10H7N5O2
Molecular Weight: 229.1949

Identification/Properties


Computed Properties
Molecular Weight:
229.199g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
229.06g/mol
Monoisotopic Mass:
229.06g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
359
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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