chempirical

Cyclopentylboronic acid

C5H11BO2CAS 63076-51-7113.95 g/mol

Open in Covalent MOL file
BHOHO
Boronic acid

Properties

Molecular formula
C5H11BO2
Molar mass
113.95 g/mol
Exact mass
114.0852 Da
logP
0.40Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

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
63076-51-7
SMILES
B(C1CCCC1)(O)O
InChIKey
VTTDFSNKIMAQTB-UHFFFAOYSA-N
InChI
InChI=1S/C5H11BO2/c7-6(8)5-3-1-2-4-5/h5,7-8H,1-4H2

Weigh it out

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Work with Cyclopentylboronic acid

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

B-Cyclohexylboronic acid4441-56-993 % similar Cyclobutylboronic acid849052-26-287 % similar Cyclopropylboronic acid411235-57-973 % similar 9-Borabicyclo[3.3.1]nonane dimer21205-91-439 % similar trans-1,2-Cyclohexanediol1460-57-732 % similar cis-1,2-Cyclohexanediol1792-81-032 % similar Cyclohexane-1,2-diol931-17-932 % similar Cyclopentanol96-41-332 % similar

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

Same formula

1-Pentenylboronic acid104376-24-1

Elsewhere

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