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834864-13-0 | 2H-Tetrazol-2-amine, 5-methyl-N-(phenylmethylene)-
CAS No: 834864-13-0 Catalog No: AG004V9D MDL No:
Product Description
Catalog Number:
AG004V9D
Chemical Name:
2H-Tetrazol-2-amine, 5-methyl-N-(phenylmethylene)-
CAS Number:
834864-13-0
Molecular Formula:
C9H9N5
Molecular Weight:
187.2013
IUPAC Name:
N-(5-methyltetrazol-2-yl)-1-phenylmethanimine
InChI:
InChI=1S/C9H9N5/c1-8-11-13-14(12-8)10-7-9-5-3-2-4-6-9/h2-7H,1H3
InChI Key:
GSHIZESIXDZBBN-UHFFFAOYSA-N
SMILES:
Cc1nnn(n1)N=Cc1ccccc1
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.086g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.206g/mol
Monoisotopic Mass:
187.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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