Basic information
- CAS
30805-22-2- Standard SMILES
ClC(Cl)(Cl)N1CN(C(Cl)(Cl)Cl)CN(C(Cl)(Cl)Cl)C1- InChIKey
ZGJREYUOKJFGAP-UHFFFAOYSA-N- Molecular formula
- C6H6Cl9N3
- Average molar mass
- 439.2 g/mol
- Monoisotopic mass
- 434.775846
Names & identifiers
- Preferred name
- 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane
- IUPAC
- 1,3,5-tris(trichloromethyl)-1,3,5-triazinane
Names & synonyms
30805-22-21,3,5-tris(trichloromethyl)-1,3,5-triazinaneSCHEMBL494457DTXSID70275309
Database identifiers
- CAS
30805-22-2- PubChem CID
- 35508
- DTXSID
DTXSID70275309- Nikkaji
- J1.614.948I
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 9.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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