Benzoic acid, 3-benzamido-2,4,6-triiodo-
Basic information
- CAS
86166-43-0- Standard SMILES
O=C(Nc1c(I)cc(I)c(C(=O)O)c1I)c1ccccc1- InChIKey
XVRGEZATACQIEI-UHFFFAOYSA-N- Molecular formula
- C14H8I3NO3
- Average molar mass
- 618.93 g/mol
- Monoisotopic mass
- 618.7638
Names & identifiers
- Preferred name
- Benzoic acid, 3-benzamido-2,4,6-triiodo-
- IUPAC
- 3-benzamido-2,4,6-triiodobenzoic acid
Names & synonyms
3-Benzamido-2,4,6-triiodobenzoic acidBRN 34203023-Benzoylamino-2,4,6-triiodobenzoic acidBENZOIC ACID, 3-BENZAMIDO-2,4,6-TRIIODO-Benzoic acid, 3-(benzoylamino)-2,4,6-triiodo-86166-43-0DTXSID402354304-14-00-01120 (Beilstein Handbook Reference)RefChem:327196DTXCID40157921
Database identifiers
- CAS
86166-43-0- PubChem CID
- 55476
- DTXSID
DTXSID40235430- Nikkaji
- J76.322E
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 401
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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