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637564

N-Boc-3-pyrrolidinone

Name: <I>N</I>-Boc-3-pyrrolidinone
Brand: ALDRICH

97%

Synonym(s):

N-(tert-Butoxycarbonyl)-3-pyrrolidinone

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About This Item

Empirical Formula (Hill Notation):

C₉H₁₅NO₃

CAS Number:

101385-93-7

Molecular Weight:

185.22

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24882865

MDL number:

MFCD01631194

Assay:

97%

Form:

solid

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Properties

Quality Level

100

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

Description

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

GHS05,GHS07

signalword

Danger

hcodes

H302,H315,H318,H335

pcodes

P261 - P264 - P280 - P301 + P312 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

>230.0 °F - closed cup

flash_point_c

> 110 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

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Tetrahedron Asymmetry, 16, 2539-2539 (2005)

"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)

Global Trade Item Number

SKU	GTIN
637564-10G	04061833432464
637564-1G	04061826698105