Basic information
- CAS
872407-32-4- Standard SMILES
c1ccc2c(c1)c1c(n2CCc2nn[nH]n2)CCCC1- InChIKey
UIGRFRIPXUPBJY-UHFFFAOYSA-N- Molecular formula
- C15H17N5
- Average molar mass
- 267.33 g/mol
- Monoisotopic mass
- 267.14839556
Names & identifiers
- Preferred name
- 9-[2-(2H-tetrazol-5-yl)ethyl]-1,2,3,4-tetrahydrocarbazole
- IUPAC
- 9-[2-(2H-tetrazol-5-yl)ethyl]-1,2,3,4-tetrahydrocarbazole
Names & synonyms
CTK3C5281872407-32-4DTXSID404697389-[2-(2H-Tetrazol-5-yl)ethyl]-2,3,4,9-tetrahydro-1H-carbazole
Database identifiers
- CAS
872407-32-4- PubChem CID
- 11630371
- DTXSID
DTXSID40469738
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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