Basic information
- CAS
60208-45-9- Standard SMILES
CC(O)C(=O)Nc1c(I)c(C(=O)NC(CO)CO)c(I)c(C(=O)NC(CO)CO)c1I- InChIKey
XQZXYNRDCRIARQ-UHFFFAOYSA-N- Molecular formula
- C17H22I3N3O8
- Average molar mass
- 777.1 g/mol
- Monoisotopic mass
- 776.8541
Overview
See also: Iopamidol (annotation moved to).
Names & identifiers
- Preferred name
- Bracco 15000
- IUPAC
- 1-N,3-N-bis(1,3-dihydroxypropan-2-yl)-5-(2-hydroxypropanoylamino)-2,4,6-triiodobenzene-1,3-dicarboxamide
- English name
- Bracco 15000
- Molecular formula
- C17H22I3N3O8
- Molecular weight
- 777.09
Names & synonyms
60208-45-9Bracco 15000DTXSID90860751RefChem:330202DTXCID3020926662883-00-5D-IopamidolN1,N3-Bis(1,3-dihydroxypropan-2-yl)-5-(2-hydroxypropanamido)-2,4,6-triiodoisophthalamideIopamidol-d3MFCD008679311,3-Benzenedicarboxamide,N,N'-bis[2-hydroxy- 1-(hydroxymethyl)ethyl]-5-[(2-hydroxy-1- oxopropyl)amino]-2,4,6-triiodo-1-N,3-N-bis(1,3-dihydroxypropan-2-yl)-5-(2-hydroxypropanoylamino)-2,4,6-triiodobenzene-1,3-dicarboxamide
Show more names
Halofuginone Impurity 5(±)-Iopamidol in methanol1,3-Benzenedicarboxamide, N,N'-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[(2-hydroxy-1-oxopropyl)amino]-2,4,6-triiodo-1,3-Benzenedicarboxamide, N1,N3-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[(2-hydroxy-1-oxopropyl)amino]-2,4,6-triiodo-1,3-Benzenedicarboxamide, N,N'-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[(2-hydroxy-1-oxopropyl)amino]-2,4,6-triiodo-, (+-)-
1217831-76-9B-15000;SQ-13396Iopamidol, (+/-)-GZ5XLU9D3LSCHEMBL471484CHEMBL4759972HMS5083J07(S)-N,N'-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-5-[(2-hydroxy-1-oxopropyl)amino]-2,4,6-triiodoisophthaldiamide
Properties
Computed structural properties
- XLogP
- -2.4
- Topological polar surface area
- 188 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 583
Experimental & physicochemical properties
DrugsPharmaceuticals
Physicochemical properties
- Boiling point
- 740.14 °C · 740.14°C (rough estimate)
- Density
- 2.281 · 2.281±0.06 g/cm3(Predicted)
- pka
- 10.87 · 10.87±0.46(Predicted)
- Water Solubility
- 137.9 g/L · 137.9g/L(25 ºC)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesIopamidol (CAS# 60208-45-9) is a radiological nonionic medical contrast agent.
Suppliers6 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
四川省维克奇生物科技有限公司18108052721 17743264324 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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