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Basic information
- CAS
10397-78-1- Standard SMILES
CNC(=O)c1c(I)c(NC(=O)CCCCCCCCCCC(=O)Nc2c(I)c(C(=O)O)c(I)c(C(=O)NC)c2I)c(I)c(C(=O)O)c1I- InChIKey
WPTAMNDITBLLSY-UHFFFAOYSA-N- Molecular formula
- C30H32I6N4O8
- Average molar mass
- 1,338.03 g/mol
- Monoisotopic mass
- 1,337.64885198
Names & identifiers
- Preferred name
- Isophthalamic acid, 5,5'-(decamethylenebis(carbonylimino))bis(N-methyl-2,4,6-triiodo-
- IUPAC
- 3,3'-[(1,12-Dioxododecane-1,12-diyl)bis(azanediyl)]bis[2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid]
- English name
- 5,5'-[Decamethylenebis(carbonylimino)]bis(N-methyl-2,4,6-triiodoisophthalamic acid)
- Molecular formula
- C30H32I6N4O8
- Molecular weight
- 1338.02
Names & synonyms
5,5'-[Decamethylenebis(carbonylimino)]bis(N-methyl-2,4,6-triiodoisophthalamic acid)Isophthalamic acid, 5,5'-(dodecanedioyldiimino)bis[2,4,6-triiodo-N-methyl- (7CI,8CI)5,5'-(1,12-Dioxododecane-1,12-diyldiimino)bis[2,4,6-triiodo-3-(methylcarbamoyl)benzoic acid]
Database identifiers
- CAS
10397-78-1- PubChem CID
- 25231
- DTXSID
DTXSID40146173- UNII
- I7GB1YG0GB
- Nikkaji
- J41.102G
Properties
Physicochemical properties
- Melting point
- 288 °C · 288 °C
- Boiling point
- 900.2 · 900.2±65.0 °C(Predicted)
- Density
- 2.28 · 2.280±0.06 g/cm3(Predicted)
- pka
- 0.56 · 0.56±0.10(Predicted)
- FDA UNII
- 7 GB1YG0GB · I7GB1YG0GB
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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