Basic information
- CAS
24481-35-4- Standard SMILES
CCCCCCCCCCCCCCCCCc1nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n1- InChIKey
KXSWPQWVAWQVBI-UHFFFAOYSA-N- Molecular formula
- C22H35Cl6N3
- Average molar mass
- 554.2 g/mol
- Monoisotopic mass
- 551.096214
Names & identifiers
- Preferred name
- 2-Heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine
- IUPAC
- 2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine
Names & synonyms
2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazineDTXSID5027495624481-35-4RefChem:261368DTXCID002264052-heptadecyl-4,6-bis(trichloromethyl)-symm-triazine
Database identifiers
- CAS
24481-35-4- PubChem CID
- 32440
- DTXSID
DTXSID50274956- Nikkaji
- J1.611.287I
Properties
Computed structural properties
- XLogP
- 12.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 420
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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