[(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid

Basic Information

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CAS Number

204688-61-9

Molecular Formula

C11H19NO4

Molecular Weight

229.28 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 Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Yellow Solid

Boiling Point

357.4°C at 760 mmHg

SMILES

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CC(C)(C)OC(=O)N1CCC(C1)CC(=O)O

InChI

InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-5-4-8(7-12)6-9(13)14/h8H,4-7H2,1-3H3,(H,13,14)/t8-/m0/s1

InChIKey

SKEXQIJIXQSFRX-QMMMGPOBSA-N

LogP

1.7181

Topological Polar Surface Area

66.84 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

282

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

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

(S)-3-carboxymethyl-pyrrolidine-1-carboxylic acid tert butyl ester
s-1-boc-pyrrolidin-3-acetic acid
(s)-n-boc-pyrrolidine-3-acetic acid
(R)-1-BOC-3-PYRROLIDINE ACETIC ACID
(s)-1-tert-butoxycarbonylpyrrolidine-3-acetic acid
(s)-2-(1-(tert-butoxycarbonyl)pyrrolidin-3-yl)aceticacid
(S)-(1-Boc-pyrrolidin-3-yl)-acetic acid, AldrichCPR
AMY14492
2-[(3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetic acid
GS-3891
((3S)-1-{[(1,1-dimethylethyl)oxy]carbonyl}-3-pyrrolidinyl)acetic acid
(S)-N-Boc-3-pyrrolidineacetic acid
CS-B0997
2-[(3S)-1-[(tert-butoxy)carbonyl]pyrrolidin-3-yl]acetic acid
(S)-1-Boc-3-Carboxymethylpyrrolidine
SCHEMBL874037
SKEXQIJIXQSFRX-QMMMGPOBSA-N
(s)-2-(1-(tert-butoxycarbonyl)pyrrolidin-3-yl)acetic acid
(S)-(1-Boc-pyrrolidin-3-yl)acetic acid
(S)-(1-Boc-Pyrrolidin-3-yl)-acetic acid
AC-6303
EN300-155897
(S)-2-(1-(tert-Butoxycarbonyl)-pyrrolidin-3-yl)acetic acid
[(3s)-1-(tert-butoxycarbonyl)pyrrolidin-3-yl]acetic acid
3-PYRROLIDINEACETIC ACID, 1-[(1,1-DIMETHYLETHOXY)CARBONYL]-, (3S)-
DTXSID30363615
(S)-2-(1-BOC-pyrrolidin-3-yl)acetic acid
AKOS015898194
(s)-3-carboxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
MFCD05861546
204688-61-9

MDL Number

MFCD05861546

Customs Code

2933990090

FAQ

What is [(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9)?

[(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9) is a cyclic amide derivative used primarily in pharmaceutical applications. It is characterized by its molecular structure, which includes a pyrrolidine ring and an acetic acid moiety.

What are the main uses of [(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9)?

[(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9) is mainly used as an intermediate in the synthesis of pharmaceuticals, particularly in the development of certain antibiotics and antimicrobial agents.

Is [(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9) safe?

[(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9) is considered safe when used under proper safety guidelines. It is important to follow all safety precautions, including the use of personal protective equipment and proper ventilation during handling and synthesis.

How should [(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9) be stored?

[(3S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl]acetic acid (CAS: 204688-61-9) 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 protect it from moisture and air exposure. Proper storage conditions are essential to maintain its stability and reactivity.