(2,2,3,3-Tetrafluoropropoxy)acetic acid
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Basic information
- CAS
870-51-9- Standard SMILES
O=C(O)COCC(F)(F)C(F)F- InChIKey
LGOWEDZMVMBETP-UHFFFAOYSA-N- Molecular formula
- C5H6F4O3
- Average molar mass
- 190.09 g/mol
- Monoisotopic mass
- 190.0253067
Names & identifiers
- Preferred name
- (2,2,3,3-Tetrafluoropropoxy)acetic acid
- IUPAC
- 2-(2,2,3,3-tetrafluoropropoxy)acetic acid
- English name
- CHEMBRDG-BB 5108929
- Molecular formula
- C5H6F4O3
- Molecular weight
- 190.09
Names & synonyms
870-51-9(2,2,3,3-tetrafluoropropoxy)acetic acidDTXSID80385160RefChem:205324DTXCID903361832-(2,2,3,3-tetrafluoropropoxy)acetic AcidMFCD00516982Cambridge id 5108929LGOWEDZMVMBETP-UHFFFAOYSA-NALBB-004290AKOS002665833SB85482
Show more names
CHEMBRDG-BB 51089292-(2,2,3,3-Tetrafluoropropoxy)(2,2,3,3-tetrafluoropropoxy)acetic acid(SALTDATA: FREE)
AS-65271DA-18684(2,2,3,3-tetra-fluoropropoxy)acetic acid2-(2,2,3,3-tetrafluoropropoxy)aceticAcidCS-03170532-(2,2,3,3-Tetrafluoropropoxy);acetic acidH23375Acetic acid, 2-(2,2,3,3-tetrafluoropropoxy)-
Database identifiers
- CAS
870-51-9- PubChem CID
- 2827675
- DTXSID
DTXSID80385160
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 159
Physicochemical properties
- Boiling point
- 248.7 · 248.7±40.0 °C(Predicted)
- Density
- 1.415 · 1.415
- Flash point
- 104.2 ℃ · 104.2℃
- pka
- 3.18 · 3.18±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 305 · P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36
- WGK Germany
- 3 · 3
- HazardClass
- IRRITANT
- HS Code
- 29159000 · 29159000
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
- wgk
- 3
- hs_code
- 29159000
- risk_code
- 36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H319
- Precautionary statements
- P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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