Basic information
- CAS
29553-26-2- Standard SMILES
CC(C)(O)C(F)(F)C(F)F- InChIKey
NCMPMCXQKBZXGI-UHFFFAOYSA-N- Molecular formula
- C5H8F4O
- Average molar mass
- 160.11 g/mol
- Monoisotopic mass
- 160.05112752
Names & identifiers
- Preferred name
- 2-Methyl-3,3,4,4-tetrafluoro-2-butanol
- IUPAC
- 3,3,4,4-tetrafluoro-2-methylbutan-2-ol
- English name
- 2,2,3,3-TETRAFLUORO-1,1-DIMETHYLPROPANOL
- Molecular formula
- C5H8F4O
- Molecular weight
- 160.11
Names & synonyms
29553-26-22-Methyl-3,3,4,4-tetrafluoro-2-butanol2,2,3,3-Tetrafluoro-1,1-dimethylpropanol2-Butanol, 3,3,4,4-tetrafluoro-2-methyl-3,3,4,4-Tetrafluoro-2-methyl-2-butanolEINECS 249-692-8UNII-0XK3480CJRNSC 86110BRN 18158270XK3480CJR2-BUTANOL, 2-METHYL-3,3,4,4-TETRAFLUORO-NSC-86110
Show more names
3,3,4,4-tetrafluoro-2-methyl-2-butano2-methyl-3,3,4,4-tetrafluoro-2-butano1,1,2,2-Tetrafluoro-3-methyl-3-butanol
DTXSID9022283RefChem:88054DTXCID202283249-692-8NCMPMCXQKBZXGI-UHFFFAOYSA-N3,3,4,4-Tetrafluoro-2-methylbutan-2-ol2-Methyl-3.3.4.4-tetrafluoro-2-butanolNSC86110
Database identifiers
- CAS
29553-26-2- PubChem CID
- 34628
- DTXSID
DTXSID9022283- UNII
- 0XK3480CJR
- EC Number
- 249-692-8
- Nikkaji
- J25.042B
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 121
Physicochemical properties
- Boiling point
- 117 °C · 117°C (rough estimate)
- Density
- 1.28 · 1.2800
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 0 XK3480CJR · 0XK3480CJR
- EPA Substance Registry System
- 2 · 2-Methyl-3,3,4,4-tetrafluoro-2-butanol (29553-26-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationS - indicates a substance that is identified in a final Significant New Use Rule.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Butanol, 3,3,4,4-tetrafluoro-2-methyl-: INACTIVE
Suppliers2 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [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
Loading…