Basic information
- CAS
100482-55-1- Standard SMILES
OC(C=C(C(F)(F)F)C(F)(F)F)c1cccs1- InChIKey
DTHGYDUZALFGDB-UHFFFAOYSA-N- Molecular formula
- C9H6F6OS
- Average molar mass
- 276.2 g/mol
- Monoisotopic mass
- 276.00435496
Names & identifiers
- Preferred name
- 4,4,4-Trifluoro-1-(thiophen-2-yl)-3-(trifluoromethyl)but-2-en-1-ol
- IUPAC
- 4,4,4-trifluoro-1-thiophen-2-yl-3-(trifluoromethyl)but-2-en-1-ol
- English name
- 1-(2-Thienyl)-4,4,4-trifluoro-3-trifluoromethyl-2-buten-1-ol
- Molecular weight
- 0
Names & synonyms
100482-55-14,4,4-trifluoro-1-(thiophen-2-yl)-3-(trifluoromethyl)but-2-en-1-olDTXSID30905539RefChem:1069303DTXCID7013346431-(2-Thienyl)-4,4,4-trifluoro-3-trifluoromethyl-2-buten-1-ol4,4,4-trifluoro-1-thiophen-2-yl-3-(trifluoromethyl)but-2-en-1-olNSC1621382-BUTEN-1-OL, 1-THENYL-4,4,4-TRIFLUORO-3-TRIFLUOROMETHYL-2-Thiophenemethanol, alpha-(3,3,3-trifluoro-2-trifluoromethylpropenyl)-alpha-(3,3,3-Trifluoro-2-trifluoromethylpropenyl)-2-thiophenemethanol2-Thiophenemethanol, a-[3,3,3-trifluoro-2-(trifluoromethyl)-1-propen-1-yl]-
Show more names
NSC-1621382-Thiophenemethanol, .alpha.-[3,3,3-trifluoro-2-(trifluoromethyl)-1-propen-1-yl]-2-Thiophenemethanol, alpha-[3,3,3-trifluoro-2-(trifluoromethyl)-1-propen-1-yl]-
Database identifiers
- CAS
100482-55-1- PubChem CID
- 57915
- DTXSID
DTXSID30905539- Nikkaji
- J65.758A
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 279
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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