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Key Documents

674540

Sigma-Aldrich

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
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

97%

form

solid

mp

32-36 °C

SMILES string

O=Cc1cc2ccccc2s1

InChI

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

InChI key

NXSVNPSWARVMAY-UHFFFAOYSA-N

Application

Preparation of the corresponding vinyl benzyl ether using Julia olefination.

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

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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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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