Basic information
- CAS
626-44-8- Standard SMILES
Ic1cc(I)cc(I)c1- InChIKey
WXLJJIHGDBUBJM-UHFFFAOYSA-N- Molecular formula
- C6H3I3
- Average molar mass
- 455.8 g/mol
- Monoisotopic mass
- 455.7369
Names & identifiers
- Preferred name
- Benzene, 1,3,5-triiodo-
- IUPAC
- 1,3,5-triiodobenzene
- English name
- 1,3,5-TRIIODOBENZENE
- Molecular formula
- C6H3I3
- Molecular weight
- 455.8
Names & synonyms
1,3,5-TRIIODOBENZENEBenzene, 1,3,5-triiodo-DTXSID30211647RefChem:117291DTXCID60134138WXLJJIHGDBUBJM-UHFFFAOYSA-N626-44-8MFCD02690052C6H3I31,3,5-Triiodobenzene #SCHEMBL1334338AKOS008024697
Show more names
5-Triiodobenzene2,4,6-Triiodobenzene1,3,5-TRIIODOBENZENE, 95 %
CS-W005324DS-3673SY113139Z56755984AMY011A868414SCHEMBL394484F790794
Database identifiers
- CAS
626-44-8- PubChem CID
- 12282
- DTXSID
DTXSID30211647- Nikkaji
- J134.628H
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 63.3
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Melting point
- 184.2 °C · 184.2°C
- Boiling point
- 381.91 °C · 381.91°C (rough estimate)
- Density
- 2.8493 · 2.8493 (rough estimate)
- refractive index
- 1.807 · 1.8070 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- color
- White to Off-White
- InChI
- InChI=1S/C6H3I3/c7-4-1-5(8)3-6(9)2-4/h1-3H
- InChIKey
- WXLJJIHGDBUBJM-UHFFFAOYSA-N
- SMILES
- C1(I)=CC(I)=CC(I)=C1
- Symbol(GHS)
- 7 · GHS07
- Signal word
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
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
Uses1,3,5-Triiodobenzene is used in the synthesis of conjugated microporous polymers through cationic cyclization polymerization. It also can be used in optical materials.
Upstream & downstream products
Downstream products
Suppliers68 total
湖北蝶化新材料科技有限公司86-18372897-544 18995560451 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
陕西格列弗生物科技研究有限责任公司18409274651; 13892423764 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
Related reactions
4 records
Compound notes
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