Methyl Undecafluorohexanoate
Basic information
- CAS
424-18-0- Standard SMILES
COC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
NJXMLQHJFDKLKL-UHFFFAOYSA-N- Molecular formula
- C7H3F11O2
- Average molar mass
- 328.08 g/mol
- Monoisotopic mass
- 327.99573912
Names & identifiers
- Preferred name
- Methyl Undecafluorohexanoate
- IUPAC
- methyl 2,2,3,3,4,4,5,5,6,6,6-undecafluorohexanoate
- English name
- Methyl perfluorohexanoate
- Molecular formula
- C7H3F11O2
- Molecular weight
- 328.08
Names & synonyms
methyl 2,2,3,3,4,4,5,5,6,6,6-undecafluorohexanoateMethyl UndecafluorohexanoateRefChem:818114677-545-1Methyl perfluorohexanoate424-18-0MFCD06200802DTXSID20335700Undecafluorohexanoic Acid Methyl EsterC5F11COOCH3Methyl perfluoro-n-hexanoateSCHEMBL2691635
Show more names
Methylperfluorohexanoate98%Methyl perfluorohexanoate 98%MethylUndecafluorohexanoate>Perfluorohexanoic Acid Methyl EsterMETHYL PERFLUOROHEXANOATE ISO 9001：2015 REACH
Perfluorohexanoic Acid Methyl EsterMSK160383AKOS005254344BS-23645CS-0121454M1913NS00019078D91551
Database identifiers
- CAS
424-18-0- PubChem CID
- 526464
- DTXSID
DTXSID20335700- EC Number
- 677-545-1
- Nikkaji
- J454.502H
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 383
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> OECD Category
Physicochemical properties
- Boiling point
- 121 · 121
- Density
- 1.579 · 1.579
- refractive index
- 1.3039 · 1.3039
- Flash point
- 21 ℃ · 21℃
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Sparingly), DMSO (Slightly), Methanol (Slightly)
- form
- Oil
- color
- Colourless
- EPA Substance Registry System
- Methyl perfluorohexanoate (424-18-0)
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 225 · H225-H315-H319-H335
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
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, 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
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Safety data
- ridadr
- UN 1993 3/PG II
- hs_code
- 29159000
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- F
- hazard_class
- 3
- packing_group
- II
- Hazard statements
- H225-H315-H319-H335
- Precautionary statements
- P210-P280
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
Related reactions
1 records
Compound notes
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