Acetic acid, (3-(N-methylacetamido)-2,4,6-triiodophenoxy)-
Basic information
- CAS
13080-24-5- Standard SMILES
CC(=O)N(C)c1c(I)cc(I)c(OCC(=O)O)c1I- InChIKey
NJFAOLRJDWASHP-UHFFFAOYSA-N- Molecular formula
- C11H10I3NO4
- Average molar mass
- 600.91 g/mol
- Monoisotopic mass
- 600.7744
Names & identifiers
- Preferred name
- Acetic acid, (3-(N-methylacetamido)-2,4,6-triiodophenoxy)-
- IUPAC
- 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]acetic acid
- English name
- [3-(N-Methylacetylamino)-2,4,6-triiodophenoxy]acetic acid
- Molecular weight
- 0
Names & synonyms
13080-24-5BRN 2166049ACETIC ACID, (3-(N-METHYLACETAMIDO)-2,4,6-TRIIODOPHENOXY)-(3-(N-Methylacetamido)-2,4,6-triiodophenoxy)acetic acidDTXSID50156748RefChem:316188DTXCID8079239[3-(N-Methylacetylamino)-2,4,6-triiodophenoxy]acetic acid2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]acetic acid[2,4,6-Triiodo-3-(N-methylacetamido)phenoxy]acetic acid
Database identifiers
- CAS
13080-24-5- PubChem CID
- 25688
- DTXSID
DTXSID50156748- Nikkaji
- J86.239H
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 355
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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