2,3,4,5-Tetraiodothiophene
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Basic information
- CAS
19259-11-1- Standard SMILES
Ic1sc(I)c(I)c1I- InChIKey
VWDOXSASHQWCRB-UHFFFAOYSA-N- Molecular formula
- C4I4S
- Average molar mass
- 587.73 g/mol
- Monoisotopic mass
- 587.59
Names & identifiers
- Preferred name
- 2,3,4,5-Tetraiodothiophene
- IUPAC
- 2,3,4,5-tetraiodothiophene
- English name
- TETRAIODOTHIOPHENE
- Molecular formula
- C4I4S
- Molecular weight
- 587.73
Names & synonyms
2,3,4,5-Tetraiodothiophene19259-11-1THIOPHENE, TETRAIODO-DTXSID00172857RefChem:1059188DTXCID4095348242-924-9TetraiodothiopheneC4I4SEINECS 242-924-9NSC 109401BRN 0118445
Show more names
tetraiodo-thiophenThiophene, 2,3,4,5-tetraiodo-
NSC994464-17-00-00255 (Beilstein Handbook Reference)SCHEMBL11297497VWDOXSASHQWCRB-UHFFFAOYSA-NMFCD00014524NSC-99446NSC109401AKOS015964913
Database identifiers
- CAS
19259-11-1- PubChem CID
- 29523
- DTXSID
DTXSID00172857- EC Number
- 242-924-9
- Nikkaji
- J48.875E
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 96.7
Physicochemical properties
- Melting point
- 198 °C · 198 °C
- Boiling point
- 445.2 · 445.2±45.0 °C(Predicted)
- Density
- 3.515 · 3.515±0.06 g/cm3(Predicted)
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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