[2-(tert-butoxycarbonylamino)-3-pyridyl]boronic acid

Basic Information

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CAS Number

863753-35-9

Molecular Formula

C10H15BN2O4

Molecular Weight

238.05 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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O=C(NC1=NC=CC=C1B(O)O)OC(C)(C)C

InChI

InChI=1S/C10H15BN2O4/c1-10(2,3)17-9(14)13-8-7(11(15)16)5-4-6-12-8/h4-6,15-16H,1-3H3,(H,12,13,14)

InChIKey

QOAIOWWKQBFCQE-UHFFFAOYSA-N

LogP

0.10839999999999961

Topological Polar Surface Area

91.68 Å²

Hydrogen Bond Donor/Acceptor

3 / 6

Synonyms & References

English

(2-[(tert-Butoxycarbonyl)amino]pyridin-3-yl)boronic acid
(2-((tert-butoxycarbonyl)amino)pyridin-3-yl)boronic acid
(2-[(tert-Butoxycarbonyl)amino]-pyridin-3-yl)boronic acid
[2-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid
2-(t-Butoxycarbonylamino)pyridine-3-boronic acid
2-(Tert-butoxycarbonyl)pyridin-3-ylboronicacid
2-(tert-butoxycarbonylamino)pyridin-3-ylboronic acid
2-(tert-Butoxycarbonylamino)pyridine-3-boronic acid
Carbamic acid, (3-borono-2 -pyridinyl)-, C-(1,1-dimethylethyl) ester
Carbamic acid, N-(3-borono-2-pyridinyl)-,C-(1,1-dimethylethyl) ester
(2-(BOC-AMINO)-PYRIDIN-3-YL)BORONIC ACID
2-(BOC-AMINO)PYRIDINE-3-BORONIC ACID
2-N-t-butoxycarbonyl-3-pyridine boric acid
2-t-butoxycarbonylamino-3-pyridineboronic acid
2-tert-butoxycarbonylamino-3-pyridineboronic acid
2-tert-butoxycarbonylamino-3-pyridylboronic acid
(2-[(tert-butoxycarbonyl)amino]pyridin-3-yl)boronic acid

MDL Number

MFCD10696635

Customs Code

2933399090

FAQ

What are the physical and chemical properties of [2-(tert-butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9)?

[2-(tert-butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9) is a white crystalline solid with a molecular weight of approximately 304.35 g/mol. It is slightly soluble in water and ethanol. The compound has a moderate reactivity in boronate ester formation and other nucleophilic substitution reactions. It is stable under normal storage conditions but should be protected from moisture and air.

How is [2-(tert-butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9) typically synthesized?

[2-(tert-Butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9) can be synthesized through the condensation of 2-amino-3-pyridineboronic acid with tert-butyloxycarbonyl chloride in the presence of a suitable base such as triethylamine. The reaction yields a mixture that can be purified by recrystallization or column chromatography, with a yield typically around 80-85%.

What industries use [2-(tert-butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9)?

[2-(tert-Butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9) finds applications in pharmaceuticals for the synthesis of biologically active compounds, in polymers for modifying their properties, and in sensors for detection of various analytes. It is also used in the semiconductor industry for producing functionalized materials.

What precautions should be taken when handling [2-(tert-butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9)?

When handling [2-(tert-Butoxycarbonylamino)-3-pyridyl]boronic acid (CAS: 863753-35-9), it is important to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. The compound should be stored in a dry place away from moisture and handled in a fume hood to avoid inhalation. In case of spill, it should be cleaned up carefully, and the area should be ventilated. Always refer to the Safety Data Sheet (SDS) for detailed safety information.