Benzoic acid, 3-propionamido-2,4,6-triiodo-
Basic information
- CAS
76265-08-2- Standard SMILES
CCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I- InChIKey
WEVROIGJAJUNOV-UHFFFAOYSA-N- Molecular formula
- C10H8I3NO3
- Average molar mass
- 570.89 g/mol
- Monoisotopic mass
- 570.7638
Names & identifiers
- Preferred name
- Benzoic acid, 3-propionamido-2,4,6-triiodo-
- IUPAC
- 2,4,6-triiodo-3-(propanoylamino)benzoic acid
Names & synonyms
BENZOIC ACID, 3-PROPIONAMIDO-2,4,6-TRIIODO-76265-08-2BRN 33843733-Propionylamino-2,4,6-triiodobenzoic acid3-Propionamido-2,4,6-triiodobenzoic acidBenzoic acid, 2,4,6-triiodo-3-((1-oxopropyl)amino)-2,4,6-triiodo-3-propanamidobenzoic acidDTXSID30227127
Database identifiers
- CAS
76265-08-2- PubChem CID
- 53468
- DTXSID
DTXSID30227127- Nikkaji
- J87.243A
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 313
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…