6-(4-Chlorophenoxy)-1,3,5-triazine-2,4-diamine
Basic information
- CAS
30360-78-2- Standard SMILES
Nc1nc(N)nc(Oc2ccc(Cl)cc2)n1- InChIKey
HTGAJHMFHVTAJX-UHFFFAOYSA-N- Molecular formula
- C9H8ClN5O
- Average molar mass
- 237.64 g/mol
- Monoisotopic mass
- 237.0417376
Names & identifiers
- Preferred name
- 6-(4-Chlorophenoxy)-1,3,5-triazine-2,4-diamine
- IUPAC
- 6-(4-chlorophenoxy)-1,3,5-triazine-2,4-diamine
Names & synonyms
6-(4-chlorophenoxy)-1,3,5-triazine-2,4-diamine30360-78-2DTXSID60275212
Database identifiers
- CAS
30360-78-2- PubChem CID
- 35122
- DTXSID
DTXSID60275212- Nikkaji
- J1.613.449J
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 99.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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