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637564

Sigma-Aldrich

N-Boc-3-pyrrolidinone

97%

Synonym(s):

N-(tert-Butoxycarbonyl)-3-pyrrolidinone

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About This Item

Empirical Formula (Hill Notation):
C9H15NO3
CAS Number:
Molecular Weight:
185.22
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

form

solid

mp

34-38 °C (lit.)

functional group

ketone

storage temp.

−20°C

SMILES string

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

InChI

1S/C9H15NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h4-6H2,1-3H3

InChI key

JSOMVCDXPUXKIC-UHFFFAOYSA-N

Application

N-Boc-3-pyrrolidinone can be used as starting material in the synthesis of spirocyclic tetrahydrofuran.
Used in a study of asymmetric hydrogen-transfer bioreduction of ketones with Leifsonia alcohol dehydrogenase.

Pictograms

CorrosionExclamation mark

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

>230.0 °F - closed cup

Flash Point(C)

> 110 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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"Synthesis of a family of spirocyclic scaffolds: building blocks for the exploration of chemical space"
Kumar S, et al.
The Journal of Organic Chemistry, 78'(13), 6529-6539 (2013)
Tetrahedron Asymmetry, 16, 2539-2539 (2005)

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