1-Benzyl-4-ethyltetrazol-5-imine
Basic information
- CAS
501358-88-9- Standard SMILES
CCn1nnn(Cc2ccccc2)c1=N- InChIKey
DICPHPSJKLLXEC-UHFFFAOYSA-N- Molecular formula
- C10H13N5
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.11709544
Names & identifiers
- Preferred name
- 1-Benzyl-4-ethyltetrazol-5-imine
- IUPAC
- 1-benzyl-4-ethyltetrazol-5-imine
- English name
- 5H-Tetrazol-5-imine,1-ethyl-1,4-dihydro-4-(phenylmethyl)-(9CI)
- Molecular formula
- C10H13N5
- Molecular weight
- 203.24
Names & synonyms
501358-88-91-Benzyl-4-ethyl-1,4-dihydro-5H-tetrazol-5-imine1-benzyl-4-ethyltetrazol-5-imineDTXSID80328214AKOS024405967DB-2160035H-Tetrazol-5-imine, 1-ethyl-1,4-dihydro-4-(phenylmethyl)-5H-Tetrazol-5-imine,1-ethyl-1,4-dihydro-4-(phenylmethyl)-(9CI)
Database identifiers
- CAS
501358-88-9- PubChem CID
- 408091
- DTXSID
DTXSID80328214
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 257
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Compound notes
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