BOC-ALA-NH2 | CAS No. 85642-13-3

BOC-ALA-NH2

Basic Information

View in Editor

CAS Number

85642-13-3

Molecular Formula

C8H16N2O3

Molecular Weight

188.23 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 Physical Properties

Boiling Point

343.1 °C at 760 mmHg

Density

1.081

Water Solubility

Soluble in water or 1% acetic acid.

Flash Point

161.3 °C

Refractive Index

1.463

SMILES

View in Editor

C[C@H](NC(=O)OC(C)(C)C)C(=O)N

InChI

InChI=1S/C8H16N2O3/c1-5(6(9)11)10-7(12)13-8(2,3)4/h5H,1-4H3,(H2,9,11)(H,10,12)/t5-/m0/s1

InChIKey

GZKKSKKIABUUCX-YFKPBYRVSA-N

LogP

0.38490000000000013

Topological Polar Surface Area

81.42 Å²

Hydrogen Bond Donor/Acceptor

3 / 5

Synonyms & References

English

Boc-L-alanine amide
Boc-Ala-NH2
N-tert-Butoxycarbonyl-L-alanine amide
Boc-Beta-ala-NH2
N-Boc-L-alaninamide
tert-butyl N-[(2S)-1-amino-1-oxopropan-2-yl]carbamate
2-(tert-butoxycarbonylamino)propionamide
AmbotzBAA5310
BocNH-Ala-NH2
N-(tert-butoxycarbonyl)lalanine amide
N-(tert-butoxycarbonyl)-S-alaninamide
NH2-Ala-NHBoc

MDL Number

MFCD03701447

Customs Code

2924199090

FAQ

What are the physical and chemical properties of BOC-ALA-NH2 (CAS: 85642-13-3)?

BOC-ALA-NH2 (CAS: 85642-13-3) is a white to off-white solid with a molecular weight of approximately 279.35 g/mol. It has a high solubility in organic solvents such as DMSO and DMF but is poorly soluble in water. The compound is relatively stable under normal conditions but can react with acids to release the BOC group. It exhibits good reactivity in amide formation reactions.

How is BOC-ALA-NH2 (CAS: 85642-13-3) typically synthesized?

BOC-ALA-NH2 (CAS: 85642-13-3) is typically synthesized by the amidation of L-alanine with an N-hydroxysuccinimide ester of BOC-protected amino groups. The reaction is usually catalyzed by a coupling reagent such as DCC (dicyclohexylcarbodiimide) and DMF (dimethylformamide) as a solvent. The yield is generally around 70-80%, with good selectivity for the amidation reaction.

What industries use BOC-ALA-NH2 (CAS: 85642-13-3)?

BOC-ALA-NH2 (CAS: 85642-13-3) is primarily used in the pharmaceutical and biotechnology industries for peptide synthesis and drug development. It is also used in the polymer industry for the synthesis of functional polymers and in the sensor industry for the development of biosensors. Additionally, it has applications in the semiconductor industry for preparing functional materials.

What precautions should be taken when handling BOC-ALA-NH2 (CAS: 85642-13-3)?

When handling BOC-ALA-NH2 (CAS: 85642-13-3), appropriate Personal Protective Equipment (PPE) such as gloves, goggles, and lab coats should be used. Work should be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Always consult the Material Safety Data Sheet (MSDS) or Safety Data Sheet (SDS) for detailed handling and storage information.