Basic information
- CAS
1207-84-7- Standard SMILES
Clc1nc(-c2ccccc2)nc(Cl)c1Cl- InChIKey
UZVRXBTXEACDQE-UHFFFAOYSA-N- Molecular formula
- C10H5Cl3N2
- Average molar mass
- 259.5 g/mol
- Monoisotopic mass
- 257.951831
Names & identifiers
- Preferred name
- 4,5,6-Trichloro-2-phenylpyrimidine
- IUPAC
- 4,5,6-trichloro-2-phenylpyrimidine
Names & synonyms
4,5,6-trichloro-2-phenylpyrimidine1207-84-7DTXSID90290130RefChem:285174DTXCID20241276NSC66917trichlorophenyl pyrimidineSCHEMBL376122CHEMBL1994050NSC-669174,5,6-Trichloro-2-phenyl-pyrimidineNCI60_024100
Show more names
DS-014628
Database identifiers
- CAS
1207-84-7- PubChem CID
- 249015
- DTXSID
DTXSID90290130- ChEMBL
CHEMBL1994050
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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