2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine

Basic Information

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CAS Number

114873-12-0

Molecular Formula

C14H17Cl2NO4

Molecular Weight

334.2 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

133-137 °C

Boiling Point

476.1°C at 760 mmHg

SMILES

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CC(C)(C)OC(=O)N[C@H](Cc1ccc(Cl)cc1Cl)C(=O)O

InChI

InChI=1S/C14H17Cl2NO4/c1-14(2,3)21-13(20)17-11(12(18)19)6-8-4-5-9(15)7-10(8)16/h4-5,7,11H,6H2,1-3H3,(H,17,20)(H,18,19)/t11-/m1/s1

InChIKey

KSDWBXFRQWMWHO-LLVKDONJSA-N

LogP

3.5138000000000016

Topological Polar Surface Area

75.63 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

378

Safety Information

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Hazard Statement

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

(R)-2-((tert-Butoxycarbonyl)amino)-3-(2,4-dichlorophenyl)propanoic acid
(R)-BOC-2,4-Dichlorophenylalanine
2,4-DICHLORO-D-PHENYLALANINE, N-BOC PROTECTED
Boc-2,4-dichloro-D-phenylalanine
Boc-D-2,4-Dichlorophe
Boc-D-2,4-Dichlorophenylalanine
D-Phenylalanine,2,4-dichloro-N-[(1,1-dimethylethoxy)carbonyl]-
Boc-d-phe(2,4-cl2)-oh
RARECHEM BK PT 0113
BOC-D-PHE(2,4-DICL)-OH
(R)-BOC-2,4-DICHLOROPHENYLALAN
2,4-Dichloro-N-Boc-D-phenylalanine
N-Boc-2,4-dichloro-D-phenylalanine, 98%

MDL Number

MFCD01862941

FAQ

What is 2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0)?

2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0) is a chiral amino acid derivative with potential applications in pharmaceuticals and research. It contains a D-phenylalanine backbone with a 2,4-dichlorophenyl group and a 2-methylbutyryl side chain.

What are the main uses of 2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0)?

2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0) is primarily used in the pharmaceutical industry for the synthesis of other compounds and in research for biological and medicinal studies. It may also have applications in the development of new drugs.

Is 2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0) safe?

2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0) is generally safe when handled with appropriate precautions. However, it is a hazardous chemical that requires proper protective measures such as gloves, goggles, and lab coats to prevent skin and eye contact. It should be stored in a secure, well-ventilated area away from sources of heat and light.

How should 2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0) be stored?

2,4-Dichloro-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 114873-12-0) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. Proper ventilation is necessary to avoid the accumulation of hazardous gases and fumes.