Basic information
- CAS
860399-52-6- Standard SMILES
CCN1CCCNCCN(CC)CCCNCC1- InChIKey
DXHRRFRUJIYHJM-UHFFFAOYSA-N- Molecular formula
- C14H32N4
- Average molar mass
- 256.43 g/mol
- Monoisotopic mass
- 256.26269702
Names & identifiers
- Preferred name
- 1,8-Diethyl-1,4,8,11-tetraazacyclotetradecane
- IUPAC
- 1,8-diethyl-1,4,8,11-tetrazacyclotetradecane
Names & synonyms
1,8-diethyl-1,4,8,11-tetraazacyclotetradecaneSCHEMBL3635506DXHRRFRUJIYHJM-UHFFFAOYSA-NDTXSID901253251860399-52-6
Database identifiers
- CAS
860399-52-6- PubChem CID
- 18451695
- DTXSID
DTXSID901253251- EC Number
- 921-420-9
- Nikkaji
- J2.322.253A
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 167
Related reactions
2 records
Compound notes
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