Tert-butyl 4-aminophenethylcarbamate

Basic Information

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CAS Number

94838-59-2

Molecular Formula

C13H20N2O2

Molecular Weight

236.31 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Density

1.077±0.06 g/cm3 (20 ºC 760 Torr),

Water Solubility

Slightly soluble in water.

SMILES

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CC(C)(C)OC(=O)NCCC1=CC=C(C=C1)N

InChI

InChI=1S/C13H20N2O2/c1-13(2,3)17-12(16)15-9-8-10-4-6-11(14)7-5-10/h4-7H,8-9,14H2,1-3H3,(H,15,16)

InChIKey

HOPALBZGTWDOTL-UHFFFAOYSA-N

LogP

2.3360000000000003

Topological Polar Surface Area

64.35 Å²

Hydrogen Bond Donor/Acceptor

3 / 4

Complexity

240

Safety Information

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Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

tert-Butyl 4-aminophenethylcarbamate
[2-(4-AMINOPHENYL)ETHYL]CARBAMIC ACID TERT-BUTYL ESTER
Carbamic acid,N-[2-(4-aminophenyl)ethyl]-, 1,1-dimethylethyl ester
tert-butyl N-[2-(4-aminophenyl)ethyl]carbamate
Tert-Butyl-2-(4-Aminophenyl)Ethylcarbamate
4-[2-(BOC-AMINO)ETHYL]ANILINE
[2-(4-Amino-phenyl)-ethyl]-carbamic acid tert-butyl ester
C13H20N2O2
tert-butyl (4-aminophenethyl)carbamate
tert-butyl [2-(4-aminophenyl)ethyl]carbamate
Carbamic acid, N-[2-(4-aminophenyl)ethyl]-, 1,1-dimethylethyl ester
Tert-butyl 2-(4-aminophenyl)ethylcarbamate hydrochloride
Carbamic acid, [2-(4-aminophenyl)ethyl]-, 1,1-dimethylethyl ester (9CI)
[2-(4-Aminophenyl)ethyl]carbamic acid tert-butyl ester
N-Boc-4-aminophenethylamine
N-tert-Butoxycarbonyl-2-(4-aminophenyl)ethylamine
N-tert-Butoxycarbonyl-4-aminophenethylamine
tert-Butyl (2-(4-Aminophenyl)ethyl)carbamate
NS-03200
STL557041
EN300-1228926
tert-butyl[2-(4-aminophenyl)ethyl]carbamate
SY021926
HOPALBZGTWDOTL-UHFFFAOYSA-N
[2-(4-Amino-phenyl)-ethyl]-carbamic acid tert-butyl ester, AldrichCPR
tert-butyl 2-(4-aminophenyl)ethylcarbamate
4-(2-(t-butoxycarbonyl)aminoethyl) aniline
MFCD05663961
AC-29368
SCHEMBL448114
Carbamic acid, [2-(4-aminophenyl)ethyl]-, 1,1-dimethylethyl ester (9CI); N-tert-Butoxycarbonyl-2-(4-aminophenyl)ethylamine; N-tert-Butoxycarbonyl-4-aminophenethylamine; [2-(4-Aminophenyl)ethyl]carbamic acid tert-butyl ester; tert-Butyl (2-(4-Aminophenyl)ethyl)carbamate; tert-Butyl 4-aminophenethylcarbamate

MDL Number

MFCD05663961

Customs Code

2924299090

FAQ

What are the physical and chemical properties of Tert-butyl 4-aminophenethylcarbamate (CAS: 94838-59-2)?

Tert-butyl 4-aminophenethylcarbamate is a crystalline compound with a molecular weight of approximately 268.38 g/mol. It has a solubility of about 8.5 g per 100 mL in water. Chemically, it is relatively stable but can react with strong acids and bases. It shows basic properties due to the amine group.

How is Tert-butyl 4-aminophenethylcarbamate (CAS: 94838-59-2) typically synthesized?

Tert-butyl 4-aminophenethylcarbamate can be synthesized via a multi-step process involving the coupling of tert-butyl phenylethyl carbonate with an amine. Commonly, this synthesis involves the use of a catalytic amount of a base like triethylamine and a solvent such as dichloromethane.

What industries use Tert-butyl 4-aminophenethylcarbamate (CAS: 94838-59-2)?

Tert-butyl 4-aminophenethylcarbamate is used in the pharmaceutical industry as an intermediate in the synthesis of various drugs. It is also employed in the polymer industry for the modification of polymers, and in the field of sensors for its reactivity with specific analytes.

What precautions should be taken when handling Tert-butyl 4-aminophenethylcarbamate (CAS: 94838-59-2)?

When handling Tert-butyl 4-aminophenethylcarbamate, appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat is necessary. It should be stored in a cool, dry place away from direct sunlight and flammable materials. In case of a spill, it should be managed according to the manufacturer's safety data sheet (SDS) guidelines.