(2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid

Basic Information

View in Editor

CAS Number

78553-51-2

Molecular Formula

C13H15NO4

Molecular Weight

249.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

445.0±45.0°C at 760 mmHg

SMILES

View in Editor

C=CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C13H15NO4/c1-2-6-11(12(15)16)14-13(17)18-9-10-7-4-3-5-8-10/h2-5,7-8,11H,1,6,9H2,(H,14,17)(H,15,16)/t11-/m0/s1

InChIKey

DGEZDWGCGXHLEW-NSHDSACASA-N

LogP

1.9421

Topological Polar Surface Area

75.63000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

297

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

A inverted exclamation mark-allyl-L-Gly
HY-W040416
DGEZDWGCGXHLEW-NSHDSACASA-N
AKOS005264715
(2S)-2-[[(phenylmethoxy)carbonyl]amino]-4-Pentenoic acid
(S)-2-(benzyloxycarbonylamino)pent-4-enoic acid
EN300-6977581
DTXSID90472393
CBZ-ALPHA-ALLYL-L-GLY
MFCD02094548
Z-Algly-OH
CS-W021156
(S)-2-(((Benzyloxy)carbonyl)amino)pent-4-enoic acid
(S)-2-(((Benzyloxy)carbonyl)amino)pent-4-enoicacid
SCHEMBL1162401
(2S)-2-(((Benzyloxy)carbonyl)amino)pent-4-enoic acid
(2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid
(2S)-2-(phenylmethoxycarbonylamino)pent-4-enoic acid
A865018
4-Pentenoic acid, 2-[[(phenylmethoxy)carbonyl]amino]-, (2S)-
Cbz-
78553-51-2
DS-4454
(S)-N-CBZ-2-(AMINO)PENT-4-ENOIC ACID
(2S)-2-{[(benzyloxy)carbonyl]amino}pent-4-enoic acid
PD197110

MDL Number

MFCD02094548

FAQ

What regulatory guidelines apply to (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2)?

The compound (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2) is subject to various regulatory guidelines, including REACH for registration, evaluation, authorization, and restriction of chemical substances in the European Union, as well as GHS (Globally Harmonized System of Classification and Labeling of Chemicals) for hazardous material classification. Additionally, FDA and EPA regulations may apply for its use in pharmaceuticals and environmental concerns, respectively.

Are there alternatives to (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2) in synthesis?

In synthesis, alternatives to (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2) include similar amino acid derivatives or analogous carboxylic acids, such as (2S)-2-amino-4-pentenoic acid. These substitutes can offer similar functional groups for various chemical reactions and can be used as precursors in pharmaceutical and chemical synthesis.

What is the market or research trend for (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2)?

The market for (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2) is driven by its potential applications in medicinal chemistry and pharmaceuticals. Research trends focus on its use as a building block for drug development, with increasing interest in its role in synthesizing complex molecules. Price trends indicate steady demand, but may fluctuate based on supply chain disruptions and market dynamics.

How should waste containing (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2) be handled?

Waste containing (2S)-2-{[(Benzyloxy)carbonyl]amino}-4-pentenoic acid (CAS: 78553-51-2) should be managed according to local and international regulations. Proper handling includes collection, storage in a secure, labeled container, and disposal through professional waste management services, which may include incineration or chemical treatment. Environmental precautions must be taken to prevent contamination and ensure safe disposal.