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13958-60-6 | Formamide, N-2H-tetrazol-5-yl-
CAS No: 13958-60-6 Catalog No: AG001BB4 MDL No:
Product Description
Catalog Number:
AG001BB4
Chemical Name:
Formamide, N-2H-tetrazol-5-yl-
CAS Number:
13958-60-6
Molecular Formula:
C2H3N5O
Molecular Weight:
113.0781
IUPAC Name:
N-(1,3-dihydrotetrazol-2-yl)formamide
InChI:
InChI=1S/C2H5N5O/c8-2-5-7-4-1-3-6-7/h1-2,6H,(H,3,4)(H,5,8)
InChI Key:
ZLNITCABOKDGFQ-UHFFFAOYSA-N
SMILES:
O=CNc1n[nH]nn1
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.049g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
115.096g/mol
Monoisotopic Mass:
115.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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