Basic information
- CAS
865-77-0- Standard SMILES
FC(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)I- InChIKey
VRJGWRPPKVEMMR-UHFFFAOYSA-N- Molecular formula
- C9F19I
- Average molar mass
- 595.97 g/mol
- Monoisotopic mass
- 595.87413
Names & identifiers
- Preferred name
- 1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-Hexadecafluoro-8-iodo-2-(trifluoromethyl)octane
- IUPAC
- 1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-8-iodo-2-(trifluoromethyl)octane
- English name
- PERFLUOROISONONYL IODIDE
- Molecular formula
- C9F19I
- Molecular weight
- 595.97
Names & synonyms
865-77-01,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-Hexadecafluoro-8-iodo-2-(trifluoromethyl)octaneEINECS 212-747-1Octane, 1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-8-iodo-2-(trifluoromethyl)-RefChem:409356212-747-1Perfluoroisononyl iodide1-Iodoperfluoro(7-methyloctane)1-Iodoperfluoro-7-methyloctane8GM2MMF5HLSCHEMBL3929314DTXSID7061221
Show more names
DAIKIN I-3800Perfluoroisononyliodide98%Perfluoroisononyl iodide 98%PERFLUORO-7-METHYLOCTYL IODIDE1-Iodo-7-(trifluoromethyl)hexadecafluorooctaneoctane,1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-8-iodo-2-(trifluoromethy1,1,2,2,3,3,4,4,5,5,6,6,7,8,8,8-Hexadecafluoro-1-iodo-7-(trifluoromethyl)octane
Nonadecafluoro-1-iodo-7-methyloctaneAKOS015852674Octane,1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-8-iodo-2-(trifluoromethyl)-1-Iodo-7-(trifluoromethyl)perfluorooctaneCS-0459256NS00011175
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 19
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 594
Experimental & physicochemical properties
PFAS
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> Other/unspecified
Physicochemical properties
- Boiling point
- 190 °C · 190 °C
- Density
- 1.987 · 1.987±0.06 g/cm3(Predicted)
- CAS DataBase Reference
- 865 · 865-77-0(CAS DataBase Reference)
- EPA Substance Registry System
- 1 · Octane, 1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-8-iodo-2-(trifluoromethyl)- (865-77-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 280 · P280-P302+P352-P362+P364
- Hazard Codes
- T
- Risk Statements
- 36 · 36/37/38
- Safety Statements
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
Warning
H315 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory InformationS - indicates a substance that is identified in a final Significant New Use Rule.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2903780089
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- T
- safety_code
- 26-36/37/39
- hazard_class
- TOXIC
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P280-P302+P352-P362+P364
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing InformationOctane, 1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-8-iodo-2-(trifluoromethyl)-: INACTIVE
Suppliers9 total
Clearsynth Labs Limited+91-22-26355700 · [email protected]
上海湄水化工科技有限公司021-60549325 18616193163
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
北京科易通达科技发展有限公司17743531240 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318584237 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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