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Merck
CN

674540

Benzo[b]thiophene-2-carboxaldehyde

97%

Synonym(s):

Thianaphthene-2-carboxaldehyde

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About This Item

Empirical Formula (Hill Notation):
C9H6OS
CAS Number:
Molecular Weight:
162.21
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
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Product Name

Benzo[b]thiophene-2-carboxaldehyde, 97%

InChI

1S/C9H6OS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-6H

SMILES string

O=Cc1cc2ccccc2s1

InChI key

NXSVNPSWARVMAY-UHFFFAOYSA-N

assay

97%

form

solid

mp

32-36 °C

functional group

aldehyde

Quality Level

Application

Preparation of the corresponding vinyl benzyl ether using Julia olefination.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

>230.0 °F - closed cup

flash_point_c

> 110 °C - closed cup

ppe

Eyeshields, Gloves, type N95 (US)


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Simon Surprenant et al.
Organic letters, 5(25), 4851-4854 (2003-12-05)
Julia olefination between alpha-alkoxy sulfones 2a-c and a wide variety of ketones or aldehydes afforded substituted vinyl ethers in 46-90% yields. Sulfones 2a-c were readily prepared in two steps from commercially available reagents in 68-80% yields. Optimization revealed that the
V M Manikandamathavan et al.
European journal of medicinal chemistry, 135, 434-446 (2017-05-06)
Two mononuclear copper (II) terpyridine complexes namely, [Cu(Btptpy) (ClO
Niina Tani et al.
Bioorganic & medicinal chemistry, 22(23), 6655-6664 (2014-12-03)
Inhibition of CYP2A6-mediated nicotine metabolism can reduce cigarette smoking. We sought potent and selective CYP2A6 inhibitors to be used as leads for drugs useful in smoking reduction therapy, by evaluating CYP2A6 inhibitory effect of novel formyl, alkyl amine or carbonitrile

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