Potassium 2-fluoro-5-formylphenyltrifluoroborate

• CAS: 1012868-70-0
• Catalog Number: ACM1012868700
• Category: Other Products; Borate
• Molecular Weight: 230.009
• Molecular Formula: C₇H₄BF₄KO
• Synonyms: POTASSIUM 2-FLUORO-5-FORMYLPHENYLTRIFLUOROBORATE, 1012868-70-0, MLS002705541, CTK8F0445, SMR001572170, C-2135
• IUPAC Name: potassium;trifluoro-(2-fluoro-5-formylphenyl)boranuide
• InChI Key: HCTPXGYDPRWOOU-UHFFFAOYSA-N
• Exact Mass: 229.99300
• H-Bond Acceptor: 6
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The molecular formula is C7H4BF4KO.

What is the molecular weight of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The molecular weight is 230.01 g/mol.

What is the IUPAC name of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The IUPAC name is potassium;trifluoro-(2-fluoro-5-formylphenyl)boranuide.

What is the InChI of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The InChI is InChI=1S/C7H4BF4O.K/c9-7-2-1-5(4-13)3-6(7)8(10,11)12;/h1-4H;/q-1;+1.

What is the InChIKey of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The InChIKey is HCTPXGYDPRWOOU-UHFFFAOYSA-N.

What is the Canonical SMILES of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The Canonical SMILES is [B-](C1=C(C=CC(=C1)C=O)F)(F)(F)F.[K+].

What is the CAS number of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The CAS number is 1012868-70-0.

What is the European Community (EC) number of Potassium 2-fluoro-5-formylphenyltrifluoroborate?

The European Community (EC) number is 664-034-3.

Is Potassium 2-fluoro-5-formylphenyltrifluoroborate a canonicalized compound?

Yes, Potassium 2-fluoro-5-formylphenyltrifluoroborate is canonicalized.

Synthetic Use

Upstream Synthesis Route 1

• 352534-79-3

• 1012868-70-0

Reference: [1]Molander, Gary A.; Cooper, David J.
[Journal of Organic Chemistry, 2008, vol. 73, # 10, p. 3885 - 3891]
[2]Brox, Regine; Milanos, Lampros; Saleh, Noureldin; Baumeister, Paul; Buschauer, Armin; Hofmann, Dagmar; Heinrich, Markus R.; Clark, Timothy; Tschammer, Nuska
[Molecular Pharmacology, 2018, vol. 93, # 4, p. 309 - 322]

Downstream Synthesis Route 1

• 1012868-70-0
• 21204-67-1

• 1013120-36-9

Reference: [1]Molander, Gary A.; Oliveira, Roberta A.
[Tetrahedron Letters, 2008, vol. 49, # 7, p. 1266 - 1268]

Downstream Synthesis Route 2

• 1012868-70-0
• 1439-36-7

• 1013120-40-5

Reference: [1]Molander, Gary A.; Oliveira, Roberta A.
[Tetrahedron Letters, 2008, vol. 49, # 7, p. 1266 - 1268]

* For details of the synthesis route, please refer to the original source to ensure accuracy.