Basic information
- CAS
102395-72-2- Standard SMILES
O=C(Nc1ccc(Cl)cc1Cl)c1cc(Cl)c(O)c(C(=O)Nc2ccc(Cl)cc2Cl)c1- InChIKey
PGLHDBZVFCHRLZ-UHFFFAOYSA-N- Molecular formula
- C20H11Cl5N2O3
- Average molar mass
- 504.6 g/mol
- Monoisotopic mass
- 501.921231
Names & identifiers
- Preferred name
- Isophthalanilide, 4-hydroxy-2',2'',4',4'',5-pentachloro-
- IUPAC
- 5-chloro-1-N,3-N-bis(2,4-dichlorophenyl)-4-hydroxybenzene-1,3-dicarboxamide
Names & synonyms
SC. 121BRN 2793874Isophthalanilide, 4-hydroxy-2',2'',4',4'',5-pentachloro-102395-72-22',2'',4',4'',5-Pentachloro-4-hydroxy-isophthalanilideDTXSID40145020RefChem:349789DTXCID4067511SCHEMBL293981985-Chloro-N~1~,N~3~-bis(2,4-dichlorophenyl)-4-hydroxybenzene-1,3-dicarboxamide
Database identifiers
- CAS
102395-72-2- PubChem CID
- 59337
- DTXSID
DTXSID40145020- Nikkaji
- J86.376I
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 627
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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