chempirical

Potassium 4-formylphenyltrifluoroborate

C7H5BF3KOCAS 374564-36-0212.02 g/mol

Open in Covalent MOL file
B−OFFFK+
Aldehyde

Properties

Molecular formula
C7H5BF3KO
Molar mass
212.02 g/mol
Exact mass
212.0023 Da
logP
-1.44Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
374564-36-0
SMILES
[B-](C1=CC=C(C=C1)C=O)(F)(F)F.[K+]
InChIKey
PEWVRVCGAOIWBB-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BF3O.K/c9-8(10,11)7-3-1-6(5-12)2-4-7;/h1-5H;/q-1;+1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Potassium 4-formylphenyltrifluoroborate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Potassium 4-fluorophenyltrifluoroborate192863-35-752 % similar Potassium phenyltrifluoroborate153766-81-550 % similar 1,4-Benzenedicarboxaldehyde623-27-850 % similar Potassium 4-pyridyltrifluoroborate1111732-87-647 % similar 4-Fluorobenzaldehyde459-57-445 % similar [1,1′-Biphenyl]-4,4′-dicarboxaldehyde66-98-844 % similar 4-(Trifluoromethyl)benzaldehyde455-19-641 % similar 4-Ethylbenzaldehyde4748-78-141 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook