tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate

Basic Information

View in Editor

CAS Number

474809-21-7

Molecular Formula

C11H17N3O2

Molecular Weight

223.28 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 Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

View in Editor

CC(C)(C)OC(=O)NCC1=CC(=NC=C1)N

InChI

InChI=1S/C11H17N3O2/c1-11(2,3)16-10(15)14-7-8-4-5-13-9(12)6-8/h4-6H,7H2,1-3H3,(H2,12,13)(H,14,15)

InChIKey

JTKROKSMVFTCKQ-UHFFFAOYSA-N

LogP

1.6885

Topological Polar Surface Area

77.24 Å²

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

238

Synonyms & References

English

tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate
(2-aMino-pyridin-4-ylMethyl)-carbaMic acid tert-butyl ester
tert-butyl N-[(2-aminopyridin-4-yl)methyl]carbamate
JTKROKSMVFTCKQ-UHFFFAOYSA-N
FCH1626414
SB11438
OR302530
AK161473
AX8271215
ST24049381
(2-amino-pyridin-4-ylmethyl)-carbamic acid tertbutyl ester
tert-butyl((2-aminopyridin-4-yl)methyl)carbamate
SCHEMBL337888
tert-Butyl N-[(2-amino-4-pyridyl)methyl]carbamate
AKOS024462372
CS-0048025
ZTA80921
(2-Amino-pyridin-4-ylmethyl)-carbamic acid tert-butyl ester
CS1320
4-[(Boc-amino)methyl]pyridin-2-amine
MFCD09028166
AMY34254
AS-46508
SY098332
A854100
DB-335879
474809-21-7

MDL Number

MFCD09028166

FAQ

What are the physical and chemical properties of tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate (CAS: 474809-21-7)?

tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate is a white to off-white solid with a molecular weight of approximately 261.29 g/mol. It has a solubility of about 0.3 g/100 mL in water and is slightly soluble in common organic solvents like methanol and ethanol. The compound is reactive towards nucleophiles and can undergo hydrolysis under basic conditions. It is stable under normal storage conditions but should be protected from moisture and heat.

How is tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate (CAS: 474809-21-7) typically synthesized?

tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate is commonly synthesized via the reaction of 2-aminopyridine-4-carboxylic acid with tert-butyl isocyanide in the presence of a coupling agent such as 1-ethyl-3-(3-dimethylaminopropyl)carbodiimide (EDC) and N-hydroxysuccinimide (NHS). The reaction proceeds with good yield and selectivity, typically yielding a pure product after column chromatography.

What industries use tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate (CAS: 474809-21-7)?

tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate is used in the pharmaceutical industry as an intermediate in the synthesis of various drugs. It is also utilized in the polymer industry for modifying the properties of polymers and in the sensor industry for developing chemical sensors. Additionally, it has potential applications in the semiconductor industry as a dopant or precursor material.

What precautions should be taken when handling tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate (CAS: 474809-21-7)?

When handling tert-Butyl ((2-aminopyridin-4-yl)methyl)carbamate, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, dry place away from moisture and heat. Fume hoods should be used during handling to minimize inhalation risk. In case of spill, it should be contained and disposed of according to laboratory safety guidelines. Always refer to the Safety Data Sheet (SDS) for detailed safety information.