Basic information
- CAS
30356-66-2- Standard SMILES
O=[N+]([O-])c1ccc(Nc2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1- InChIKey
RXIJZWRKDDMFQA-UHFFFAOYSA-N- Molecular formula
- C11H5Cl6N5O2
- Average molar mass
- 451.9 g/mol
- Monoisotopic mass
- 448.857441
Names & identifiers
- Preferred name
- N-(4-nitrophenyl)-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- N-(4-nitrophenyl)-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
30356-66-2N-(4-nitrophenyl)-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amineDTXSID10275141
Database identifiers
- CAS
30356-66-2- PubChem CID
- 34972
- DTXSID
DTXSID10275141- Nikkaji
- J583.353A
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 424
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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