N,N'-(3,3'-Dichloro[1,1'-biphenyl]-4,4'-diyl)bis(heptafluorobutanimidic acid)
Basic information
- CAS
75042-09-0- Standard SMILES
O=C(Nc1ccc(-c2ccc(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)c(Cl)c2)cc1Cl)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
FHOSHAMDKGFWFV-UHFFFAOYSA-N- Molecular formula
- C20H8Cl2F14N2O2
- Average molar mass
- 645.2 g/mol
- Monoisotopic mass
- 643.9739272
Names & identifiers
- Preferred name
- N,N'-(3,3'-Dichloro[1,1'-biphenyl]-4,4'-diyl)bis(heptafluorobutanimidic acid)
- IUPAC
- N-[2-chloro-4-[3-chloro-4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)phenyl]phenyl]-2,2,3,3,4,4,4-heptafluorobutanamide
Names & synonyms
75042-09-0N,N'-(3,3'-Dichloro[1,1'-biphenyl]-4,4'-diyl)bis(heptafluorobutanimidic acid)DTXSID90996549Butanamide, N,N'-(3,3'-dichloro(1,1'-biphenyl)-4,4'-diyl)bis(2,2,3,3,4,4,4-heptafluoro-
Database identifiers
- CAS
75042-09-0- PubChem CID
- 186906
- DTXSID
DTXSID90996549
Properties
Computed structural properties
- XLogP
- 8.1
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 7
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 869
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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