1H,1H,2H,2H-Nonafluorohexyl Acrylate
Basic information
- CAS
52591-27-2- Standard SMILES
C=CC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
GYUPEJSTJSFVRR-UHFFFAOYSA-N- Molecular formula
- C4F9CH2CH2OC(O)CH=CH2
- Average molar mass
- 318.14 g/mol
- Monoisotopic mass
- 318.03023292
Names & identifiers
- Preferred name
- 1H,1H,2H,2H-Nonafluorohexyl Acrylate
- IUPAC
- 3,3,4,4,5,5,6,6,6-nonafluorohexyl prop-2-enoate
- English name
- 2-(Perfluorobutyl)ethyl acrylate
- Molecular formula
- C9H7F9O2
- Molecular weight
- 318.14
Names & synonyms
1H,1H,2H,2H-Nonafluorohexyl acrylate2-Propenoic acid, 3,3,4,4,5,5,6,6,6-nonafluorohexyl ester1,1,2,2-Tetrahydroperfluorohexyl acrylateRefChem:437634808-163-72-(Perfluorobutyl)ethyl acrylate52591-27-23,3,4,4,5,5,6,6,6-nonafluorohexyl acrylate3,3,4,4,5,5,6,6,6-nonafluorohexyl prop-2-enoate2-(nonafluorobutyl)ethyl acrylate2-(perfluorobutyl)ethylacrylateMFCD00236104
Show more names
TEAc-4DAIKIN R-1420Perfluorobutylethyl acrylate1H,1H,2H,2H-Perfluorohexyl acrylate 97%3,3,4,4,5,5,6,6,6-NonafluorohexylacrylateAcrylic acid 2-(nonafluorobutyl)ethyl ester
DTXSID10687721H,1H,2H,2H-Nonafluorohexyl Acrylate (stabilized with TBC)C9H7F9O2SCHEMBL1498363,3,4,4,5,5,6,6,6-Nonafluorohex-1yl acrylateAcrylic Acid 3,3,4,4,5,5,6,6,6-Nonafluorohexyl Ester1H,1H,2H,2H-Nonafluorohexyl Acrylate (stabilized with MEHQ)3,3,4,4,5,5,6,6,6-nonakis(fluoranyl)hexyl prop-2-enoate
Database identifiers
- CAS
52591-27-2- PubChem CID
- 104247
- DTXSID
DTXSID1068772- EC Number
- 808-163-7
- Nikkaji
- J429.188C
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 372
Experimental & physicochemical properties
PFAS
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> Fluorotelomer based substances
PFAS -> Other/unspecified
Physicochemical properties
- Melting point
- -68 °C · -68 °C
- Boiling point
- 164 °C · 164 °C
- Density
- 1.414 · 1.414
- refractive index
- 1.31 · 1.310
- Flash point
- 52 °C · 52 °C
- storage temp.
- 2 · Store at 2-8 ℃
- solubility
- Chloroform (Soluble), Ethyl Acetate (Slightly)
- form
- clear liquid
- color
- Colorless to Light yellow
- Specific Gravity
- 1.44 · 1.440
- InChI
- InChI=1S/C9H7F9O2/c1-2-5(19)20-4-3-6(10,11)7(12,13)8(14,15)9(16,17)18/h2H,1,3-4H2
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P264+P265, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, 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
Regulatory InformationS - indicates a substance that is identified in a final Significant New Use Rule.
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- tsca
- TSCA listed
- ridadr
- UN 3272 3/PG III
- hs_code
- 2916120090
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- hazard_class
- 3
- packing_group
- III
- Hazard statements
- H226-H315-H319-H335
- Precautionary statements
- P210-P280
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information2-Propenoic acid, 3,3,4,4,5,5,6,6,6-nonafluorohexyl ester: ACTIVE
Applications
Uses2-(Perfluorobutyl)ethyl Acrylate can be used as an acrylic resin surface modifier with high water repellency and oil repellency for coating agents. It can also be used in a super concentrated emulsion method to prepare a solid sheet polycarboxylic acid water reducing agent.
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Compound notes
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