Basic information
- CAS
2260-08-4- Standard SMILES
CC(=O)Oc1ccc(Oc2c(I)cc(C(=O)O)cc2I)cc1I- InChIKey
AXVCIZJRCOHMQX-UHFFFAOYSA-N- Molecular formula
- C15H9I3O5
- Average molar mass
- 649.94 g/mol
- Monoisotopic mass
- 649.7584
Overview
Acetiromate is a small molecule drug. Acetiromate has a monoisotopic molecular weight of 649.76 Da.
Names & identifiers
- Preferred name
- 4-(4-(Acetyloxy)-3-iodophenoxy)-3,5-diiodobenzoic acid
- IUPAC
- 4-(4-acetyloxy-3-iodophenoxy)-3,5-diiodobenzoic acid
- English name
- Acetiromate
- Molecular formula
- C15H9I3O5
- Molecular weight
- 649.931
Names & synonyms
Acetiromate2260-08-4AcetiromatoAcetiromatumDTXSID601771218Q5153W1NW3,5-Diiodo-4-(4'-acetoxy-3'-iodophenoxy)benzoic acid4-[4-(acetyloxy)-3-iodophenoxy]-3,5-diiodobenzoic acid4-(4-(Acetyloxy)-3-iodophenoxy)-3,5-diiodobenzoic acidRefChem:912164DTXCID90996123,5-diodo-4(3'-iodo4'-acetoxyphenoxy) benzoic acid
Show more names
Acetyltriiodothyroformic acid4-(4-Acetoxy-3-iodophenoxy)-3,5-diiodobenzoic acid3,5-Diiodo-4-(4-acetoxy-3-iodophenoxy)benzoic acid4-(4-acetyloxy-3-iodo-phenoxy)-3,5-diiodo-benzoic acid
Acetiromate [INN]4-(4-acetyloxy-3-iodophenoxy)-3,5-diiodobenzoic acid4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodobenzoic acid acetateAdecolAcetiromatum [INN-Latin]Acetiromato [INN-Spanish]TBF 43Acetyltriiodothyronine formic acid
Database identifiers
- CAS
2260-08-4- PubChem CID
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 435
Physicochemical properties
- Melting point
- 238 °C · 238°C
- Density
- 2.3074 · 2.3074 (estimate)
- FDA UNII
- 8 Q5153W1NW · 8Q5153W1NW
Chemistry & industry
Applications
UsesAcetiromate is a thyroxine analogue. Acetiromate is an antilipidemic drug for hyperlipidemia[1].
Upstream & downstream products
Upstream raw materials
Suppliers2 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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