Basic information
- CAS
958449-00-8- Standard SMILES
CCC(C)[B-](F)(F)F.[K+]- InChIKey
WOHBSAAEEGTTTL-UHFFFAOYSA-N- Molecular formula
- C4H9BF3K
- Average molar mass
- 164.02 g/mol
- Monoisotopic mass
- 164.0386464
Names & identifiers
- Preferred name
- Potassium (butan-2-yl)(trifluoro)borate(1-)
- IUPAC
- potassium butan-2-yl(trifluoro)boranuide
- English name
- POTASSIUM SEC-BUTYLTRIFLUOROBORATE
- Molecular formula
- C4H9BF3K
- Molecular weight
- 164.02
Names & synonyms
958449-00-8DTXSID80635713Potassium (butan-2-yl)(trifluoro)borate(1-)RefChem:373665DTXCID90586464Potassium sec-butyltrifluoroboratePotassium (butan-2-yl)trifluoroboranuidePotassium sec-butyl(trifluoro)borate(1-)potassium;butan-2-yl(trifluoro)boranuideSCHEMBL909416WOHBSAAEEGTTTL-UHFFFAOYSA-NMFCD08276880
Show more names
butan-2-yl(trifluoro)boranuidePotassium sec-butyltrifluoroborate 97%potassium:butan-2-yl(trifluoro)boranuidePOTASSIUM SEC-BUTYLTRIFLUOROBORATE ISO 9001：2015 REACHBorate(1-), trifluoro(1-methylpropyl)-, potassium (1:1), (T-4)-
AKOS017391029potassium;trifluoro(sec-butyl)boranuideCS-0225643Potassium (butan-2-yl)trifluoridoborate(1-)G29039EN300-1245310
Database identifiers
- CAS
958449-00-8- PubChem CID
- 23697352
- DTXSID
DTXSID80635713
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 72.7
Physicochemical properties
- Melting point
- 300 °C · >300 °C
- form
- solid
- InChI
- 1S/C4H9BF3.K/c1-3-4(2)5(6,7)8;/h4H,3H2,1-2H3;/q-1;+1
- InChIKey
- WOHBSAAEEGTTTL-UHFFFAOYSA-N
- SMILES
- [K+].CCC(C)[B-](F)(F)F
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 22 · NA.22
- WGK Germany
- 3 · 3
- Storage Class
- 13 · 13 - Non Combustible Solids
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
- Storage Class
- 13 - Non Combustible Solids
Chemistry & industry
Applications
UsesOrganotrifluoroborate involved in direct alkylation of heteroaryls and Suzuki cross-couplingOrganotrifluoroborates as versatile and stable boronic acid surrogates.
Suppliers12 total
Aladdin Scientific[email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
陕西爱施达尔生物科技有限公司18682931470; 18682931470 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
武汉鑫晟阳生物科技有限公司18402740988 18402740988 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…