Undecanoic acid, 11-(((4-chloro-2-(2-chlorobenzoyl)phenyl)sulfonyl)amino)-
Basic information
- CAS
111855-66-4- Standard SMILES
O=C(O)CCCCCCCCCCNS(=O)(=O)c1ccc(Cl)cc1C(=O)c1ccccc1Cl- InChIKey
LMTPDSJHCIQRPT-UHFFFAOYSA-N- Molecular formula
- C24H29Cl2NO5S
- Average molar mass
- 514.5 g/mol
- Monoisotopic mass
- 513.1143496
Names & identifiers
- Preferred name
- Undecanoic acid, 11-(((4-chloro-2-(2-chlorobenzoyl)phenyl)sulfonyl)amino)-
- IUPAC
- 11-[[4-chloro-2-(2-chlorobenzoyl)phenyl]sulfonylamino]undecanoic acid
Names & synonyms
Undecanoic acid, 11-(((4-chloro-2-(2-chlorobenzoyl)phenyl)sulfonyl)amino)-11-(((4-Chloro-2-(2-chlorobenzoyl)phenyl)sulfonyl)amino)undecanoic acid111855-66-4DTXSID50149751RefChem:386891DTXCID3072242SCHEMBL10333422LMTPDSJHCIQRPT-UHFFFAOYSA-N11-[2-(2-chlorobenzoyl)-4-chlorobenzenesulphonamido]undecanoic acid11-[4-Chloro-2-(2-chlorobenzoyl)benzene-1-sulfonamido]undecanoic acid
Database identifiers
- CAS
111855-66-4- PubChem CID
- 3086746
- DTXSID
DTXSID50149751
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 15
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 712
Related reactions
3 records
Compound notes
Loading…