Basic information
- CAS
587-61-1- Standard SMILES
CCCOC(=O)Cn1cc(I)c(=O)c(I)c1- InChIKey
ROSXARVHJNYYDO-UHFFFAOYSA-N- Molecular formula
- C10H11I2NO3
- Average molar mass
- 447.01 g/mol
- Monoisotopic mass
- 446.88284
Overview
Propyliodone is an organic molecular entity.
Names & identifiers
- Preferred name
- Propyliodone
- IUPAC
- propyl 2-(3,5-diiodo-4-oxo-1-pyridinyl)acetate
- English name
- Propyliodone
- Molecular formula
- C16H26O
- Molecular weight
- 234.37704
Names & synonyms
propyliodone587-61-1DionosilPropiodonePropiliodonaPropyliodonumDionosil AqueousA. G. 33-1071(4H)-Pyridineacetic acid, 3,5-diiodo-4-oxo-, propyl ester5NPJ6BPX36NSC-97103DTXSID6023527
Show more names
PropylixNSC97103NSC 97103Propyliodone USP/EP/BPPROPYLIODONE(ROPYLIODONE)
propyl 2-(3,5-diiodo-4-oxo-1,4-dihydropyridin-1-yl)acetateRefChem:57590DTXCID703527V08AD03209-603-5BrosombraDiostrilBronchodiagnostin
Database identifiers
- CAS
587-61-1- PubChem CID
- 4949
- DTXSID
DTXSID6023527- ChEMBL
CHEMBL1200821- ChEBI
CHEBI:32064- UNII
- 5NPJ6BPX36
- EC Number
- 209-603-5
- Nikkaji
- J2.072I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 341
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Physicochemical properties
- Melting point
- 186 °C · 186°C
- Boiling point
- 392.6 · 392.6±42.0 °C(Predicted)
- Density
- 2.049 · 2.0490 (estimate)
- pka
- -1.84 · -1.84±0.10(Predicted)
- FDA UNII
- 5 NPJ6BPX36 · 5NPJ6BPX36
- ATC code
- 8 AD03 · V08AD03
- Toxicity
- 50 i.v · LD50 i.v. in mice: 300 mg/kg (Tomich)
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
- Toxicity
- LD50 i.v. in mice: 300 mg/kg (Tomich)
Chemistry & industry
Pharmacology
ATC Code
V - Various
QV - Various
MeSH Pharmacological ClassificationSubstances used to allow enhanced visualization of tissues.
Applications
UsesDiagnostic aid (radiopaque medium)Dionosil (GlaxoSmithKline).
UsesPropyliodone is used in Ftorlon fibers as an X-ray absorbing substance.
Suppliers13 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
武汉沃格达生物科技有限公司15071299552 · [email protected]
Wuhan Topule Biopharmaceutical Co., Ltd
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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