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76239-51-5

76239-51-5 structural image
Product Name: 2H-1-Benzopyran-2-one, 8-butoxy-3-(1H-tetrazol-5-yl)-, sodium salt
Formula: C14H13N4NaO3
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COMPUTED DESCRIPTORS

Molecular Weight 308.27 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 308.08853457 g/mol
Monoisotopic Mass 308.08853457 g/mol
Topological Polar Surface Area 75.2 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 421
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 2
Compound Is Canonicalized Yes