Basic information
- CAS
30894-97-4- Standard SMILES
Brc1nc(Br)nc(Sc2ccccc2)n1- InChIKey
APNRCKVOLQZADS-UHFFFAOYSA-N- Molecular formula
- C9H5Br2N3S
- Average molar mass
- 347.03 g/mol
- Monoisotopic mass
- 344.85709
Names & identifiers
- Preferred name
- 2,4-Dibromo-6-phenylsulfanyl-1,3,5-triazine
- IUPAC
- 2,4-dibromo-6-phenylsulfanyl-1,3,5-triazine
Names & synonyms
2,4-dibromo-6-phenylsulfanyl-1,3,5-triazine30894-97-42,4-dibromo-6-(phenylsulfanyl)-1,3,5-triazineDTXSID10275368
Database identifiers
- CAS
30894-97-4- PubChem CID
- 35671
- DTXSID
DTXSID10275368- Nikkaji
- J1.615.882H
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 64 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 192
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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