5,5'-Bi-1H-tetrazole, 1,1'-diphenyl-
Basic information
- CAS
66012-75-7- Standard SMILES
c1ccc(-n2nnnc2-c2nnnn2-c2ccccc2)cc1- InChIKey
JYVUXSKXGWUDER-UHFFFAOYSA-N- Molecular formula
- C14H10N8
- Average molar mass
- 290.28 g/mol
- Monoisotopic mass
- 290.10284235
Names & identifiers
- Preferred name
- 5,5'-Bi-1H-tetrazole, 1,1'-diphenyl-
- IUPAC
- 1-phenyl-5-(1-phenyltetrazol-5-yl)tetrazole
Names & synonyms
66012-75-75,5'-Bi-1H-tetrazole, 1,1'-diphenyl-DTXSID70329295RefChem:298156DTXCID102803961-phenyl-5-(1-phenyltetrazol-5-yl)tetrazoleNSC111900SCHEMBL11536760JYVUXSKXGWUDER-UHFFFAOYSA-N5,5'-bis(1-phenyl-1H-tetraazole)NSC-111900DS-003159
Show more names
1,1'-Diphenyl-1H,1'H-5,5'-bitetrazoleAG-690/11351110Tetrazol, 1-phenyl- 5-(1-phenyltetrazol-5-yl)-
Database identifiers
- CAS
66012-75-7- PubChem CID
- 419191
- DTXSID
DTXSID70329295- Nikkaji
- J786.827H
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 87.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 321
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Related reactions
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Compound notes
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