1,4,16,19-Tetraoxa-7,10,13,22,25,28-hexaazacyclotriacontane
Basic information
- CAS
134656-02-3- Standard SMILES
C1CNCCOCCOCCNCCNCCNCCOCCOCCNCCN1- InChIKey
RRQQPSKKDQQXMR-UHFFFAOYSA-N- Molecular formula
- C20H46N6O4
- Average molar mass
- 434.6 g/mol
- Monoisotopic mass
- 434.35805397
Names & identifiers
- Preferred name
- 1,4,16,19-Tetraoxa-7,10,13,22,25,28-hexaazacyclotriacontane
- IUPAC
- 1,4,16,19-tetraoxa-7,10,13,22,25,28-hexazacyclotriacontane
Names & synonyms
1,4,16,19-Tetraoxa-7,10,13,22,25,28-hexaazacyclotriacontane134656-02-3DTXSID00423174
Database identifiers
- CAS
134656-02-3- PubChem CID
- 6397124
- DTXSID
DTXSID00423174- Nikkaji
- J698.169K
Properties
Computed structural properties
- XLogP
- -3.2
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 0
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 274
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Compound notes
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