(2S)-4-[(Benzyloxy)carbonyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid

Basic Information

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CAS Number

138775-03-8

Molecular Formula

C18H24N2O6

Molecular Weight

364.4 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Yellow Solid

SMILES

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CC(C)(C)OC(=O)N1CCN(CC1C(=O)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H24N2O6/c1-18(2,3)26-17(24)20-10-9-19(11-14(20)15(21)22)16(23)25-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H,21,22)/t14-/m0/s1

InChIKey

SREPAMKILVVDSP-AWEZNQCLSA-N

LogP

2.3291000000000004

Topological Polar Surface Area

96.38000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 8

Complexity

524

Safety Information

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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

(2S)-piperazine-1,2,4-tricarboxylic acid 4-benzyl ester 1-tert-butyl ester
(s)-4-(benzyloxycarbonyl)-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid
(S)-N-1-Boc-N-4-Cbz-2-piperazine carboxylic acid
(s)-piperazine-1,2,4-tricarboxylic acid 4-benzyl ester 1-tert-butyl ester
(2S)-4-[(benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)-2-piperazinecarboxylic acid
CS-0127816
138775-03-8
1,2,4-PIPERAZINETRICARBOXYLIC ACID, 1-(1,1-DIMETHYLETHYL) 4-(PHENYLMETHYL) ESTER, (2S)-
(S)-1-N-BOC-4-N-CBZ-PIPERAZINE-2-CARBOXYLIC ACID
1-boc-4-cbz-piperazine-2-(s)-carboxylic acid
SREPAMKILVVDSP-AWEZNQCLSA-N
n-boc-[(4-n-z)piperazine(2s)cooh]
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxycarbonylpiperazine-2-carboxylic acid
(2S)-4-[(BENZYLOXY)CARBONYL]-1-(TERT-BUTOXYCARBONYL)PIPERAZINE-2-CARBOXYLIC ACID
AKOS015994907
AS-38504
(S)-N1-BOC-N4-CBZ-2-PIPERAZINE CARBOXYLIC ACID
MFCD02179111
DTXSID40426684
(S)-N-1-Boc-N-4-Cbz-2-piperazinecarboxylicacid
(S)-4-(benzyloxycarbonyl)-1-(tert-butyloxycarbonyl)-piperazine-2-carboxylic acid
(S)-4-((Benzyloxy)carbonyl)-1-(tert-butoxycarbonyl)piperazine-2-carboxylicacid
(S)-4-((Benzyloxy)carbonyl)-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid
SCHEMBL1375861
(s)-1-boc-4-cbz-2-piperazine carboxylic acid
A13027
(2S)-4-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid
(S)-1-BOC-4-CBZ-2-PIPERAZINE CARBOXYLIC ACID
(S)-N-1-Boc-N-4-Cbz-2-Piperazine carboxylic acid
(2S)-4-benzyloxycarbonyl-1-tert-butoxycarbonyl-piperazine-2-carboxylic acid

MDL Number

MFCD02179111

Customs Code

2933599090

FAQ

What regulatory guidelines apply to (2S)-4-[(Benzyloxy)carbonyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid (CAS: 138775-03-8)?

This compound (CAS: 138775-03-8) is subject to various regulatory guidelines, including GHS classification for hazardous materials, REACH regulations for the European Union, and FDA/EPA requirements for safety and environmental standards. Ensure compliance with local and international regulations regarding handling, storage, and disposal to avoid legal and safety issues.

Are there alternatives to (2S)-4-[(Benzyloxy)carbonyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid in synthesis?

While (2S)-4-[(Benzyloxy)carbonyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid (CAS: 138775-03-8) is a specific compound, alternatives such as other piperazine derivatives or similar cyclic amine structures may be used depending on the synthesis requirements. Common substitutes include other carboxylic acids and their derivatives that can serve similar functional group purposes.

What is the market or research trend for (2S)-4-[(Benzyloxy)carbonyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid (CAS: 138775-03-8)?

Market trends for this compound (CAS: 138775-03-8) indicate a growing interest in its use as a precursor in medicinal chemistry and drug development, particularly for synthesizing pharmaceuticals. Research is increasingly focusing on the development of more efficient synthetic routes and the exploration of its potential applications in biological systems.

How should waste containing (2S)-4-[(Benzyloxy)carbonyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid (CAS: 138775-03-8) be handled?

Waste containing (2S)-4-[(Benzyloxy)carbonyl]-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid (CAS: 138775-03-8) should be collected in a manner that prevents environmental contamination. Proper disposal methods include incineration or professional waste disposal services that are compliant with local regulations. Ensure all safety precautions are taken to avoid exposure and environmental harm.