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Basic information
- CAS
690-22-2- Standard SMILES
CCOC(F)(F)F- InChIKey
ZPVFXWAIPNKSLJ-UHFFFAOYSA-N- Molecular formula
- C3H5F3O
- Average molar mass
- 114.07 g/mol
- Monoisotopic mass
- 114.02924926
Names & identifiers
- Preferred name
- Ether, ethyl trifluoromethyl
- IUPAC
- trifluoromethoxyethane
- English name
- Ethyl trifluoromethyl ether
- Molecular formula
- C3H5F3O
- Molecular weight
- 114.07
Names & synonyms
Ethane, (trifluoromethoxy)-Ether, ethyl trifluoromethylDTXSID8073926RefChem:341565DTXCID4046442690-22-2Ethyl trifluoromethyl ethertrifluoromethoxyethaneEthane,(trifluoromethoxy)-MFCD03094224(trifluoromethoxy)ethaneSCHEMBL9846
Show more names
3-(3,5,5-trimethylhexylamino)propanenitrile
SCHEMBL9847SCHEMBL760157(trifluoro-methyl) ethyl etherSCHEMBL17729825ASKQJITYHQMNNX-UHFFFAOYSA-NZACVFZSBRDDZKX-UHFFFAOYSA-NZPVFXWAIPNKSLJ-UHFFFAOYSA-NAKOS006228195
Database identifiers
- CAS
690-22-2- PubChem CID
- 69646
- DTXSID
DTXSID8073926- EC Number
- 671-652-7
- Nikkaji
- J1.551.508B
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 48
Physicochemical properties
- Boiling point
- 5.5 · 5.5-6 °C(Press: 753 Torr)
- Density
- 1.131 · 1.131±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- Ethane, (trifluoromethoxy)- (690-22-2)
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 225 · H225-H315-H319-H335
- Precautionary statements
- 210 · P210-P280-P243
- Hazard Codes
- Xi
- Risk Statements
- 11 · 11
- Safety Statements
- 9 · 9-16-33
- RIDADR
- 3271 · 3271
- HazardClass
- IRRITANT
- HS Code
- 2909199090 · 2909199090
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
- ridadr
- 3271
- hs_code
- 2909199090
- risk_code
- 11
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xi
- safety_code
- 9-16-33
- hazard_class
- IRRITANT
- Hazard statements
- H225-H315-H319-H335
- Precautionary statements
- P210-P280-P243
Chemistry & industry
Suppliers1 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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