(4-(Morpholine-4-carbonyl)phenyl)boronic acid

C₁₁H₁₄BNO₄CAS 389621-84-5235.05 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₄BNO₄
Molar mass: 235.05 g/mol
Exact mass: 235.1016 Da
logP: -1.16Crippen estimate
Polar surface area: 70.0 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 2

Identifiers

CAS number

389621-84-5

SMILES

O=C(c1ccc(B(O)O)cc1)N1CCOCC1

InChIKey

KMNLIQJXZPBCDU-UHFFFAOYSA-N

InChI

InChI=1S/C11H14BNO4/c14-11(13-5-7-17-8-6-13)9-1-3-10(4-2-9)12(15)16/h1-4,15-16H,5-8H2

Weigh it out

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Names and synonyms

6 names

Boronic acid, B-[4-(4-morpholinylcarbonyl)phenyl]-
Boronic acid, [4-(4-morpholinylcarbonyl)phenyl]-
B-[4-(4-Morpholinylcarbonyl)phenyl]boronic acid
[4-[(Morpholin-4-yl)carbonyl]phenyl]boronic acid
(4-Morpholinocarbonylphenyl)boronic acid
4-(Morpholinocarbonyl)benzeneboronic acid

Work with (4-(Morpholine-4-carbonyl)phenyl)boronic 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

Elsewhere

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