Perfluorodecyl iodide
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Basic information
- CAS
423-62-1- Standard SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)I- InChIKey
UDWBMXSQHOHKOI-UHFFFAOYSA-N- Molecular formula
- C10F21I
- Average molar mass
- 645.98 g/mol
- Monoisotopic mass
- 645.87094
Names & identifiers
- Preferred name
- Perfluorodecyl iodide
- IUPAC
- 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluoro-10-iododecane
- English name
- Perfluorodecyl iodide
- Molecular formula
- C10F21I
- Molecular weight
- 645.98
Names & synonyms
Perfluorodecyl iodide423-62-1Henicosafluoro-10-iododecaneDecane, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-heneicosafluoro-10-iodo-DTXSID8059974RefChem:171652207-030-51-Iodoperfluorodecane1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-Henicosafluoro-10-iododecaneHeneicosafluorodecyl IodidePerfluoro-1-iododecaneC10F21I
Show more names
IodoperfluorodecanePerfluoro-decyl iodinePerfluorodecyliodide97%PERFLUORO-N-DECYL IODIDEIodohenicosafluorodecane1-iodide perfluorodecane1-Iodoperfluorodecane,97%
Heneicosafluoro-1-iododecaneEINECS 207-030-5MFCD00001065CS-0137357Decane, heneicosafluoro-1-iodo-Heneicosafluoro-1-iodo-decane; 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-heneicosafluoro-10-iododecane; 1-Iodoheneicosafluorodecane; 1-Iodoperfluorodecane; Heneicosafluoro-1-iododecane; Perfluorodecyl iodideWG9NR28LNH1-Iodoheneicosafluorodecane
Database identifiers
- CAS
423-62-1- PubChem CID
- 67920
- DTXSID
DTXSID8059974- UNII
- WG9NR28LNH
- EC Number
- 207-030-5
- Nikkaji
- J97.540K
Properties
Computed structural propertiesFilling in
- XLogP
- 8.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 21
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 698
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> PFalkyliodides (PFAI)
Physical DescriptionLiquid
Physicochemical properties
- Melting point
- 65 · 65-67 °C
- Boiling point
- 195 · 195-200 °C
- Density
- 1.8 · 1.8
- refractive index
- 1.317 · 1.317
- Flash point
- 195 · 195-200°C
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Solid
- color
- Off-White
- Sensitive
- Light Sensitive
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 50.5% (47 of 93) of all reports.
Warning
H315 (49.5%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 93 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Decane, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-heneicosafluoro-10-iodo- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Decane, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-heneicosafluoro-10-iodo- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
S - indicates a substance that is identified in a final Significant New Use Rule.
Substance: Henicosafluoro-10-iododecane
Hazard Classes and CategoriesSkin Irrit. 2 (49.5%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- MD8710000
- hs_code
- 29033990
- risk_code
- 36/37/38
- Signal word
- Warning
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 50,000 - <250,000 lb
Industry UsesIntermediate
Use Classification
PFAS -> PFalkyliodides (PFAI)
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Decane, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-heneicosafluoro-10-iodo-: ACTIVE
Applications
UsesPerfluorodecyl iodide is used to prepare 3,5-bis(perfluorodecyl)phenylboronic acid, "green" catalyst for the direct amide condensation reaction. It is also used to synthesize 3-(perfluorodecyl)prop-1-ene.
Upstream & downstream products
Downstream products
Related reactions
6 records
Compound notes
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