686727
Benzo[b]thiophene-2-carbonitrile
97%
Synonym(s):
2-Cyanobenzothiophene, Thianaphthene-2-carbonitrile
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About This Item
Empirical Formula (Hill Notation):
C9H5NS
CAS Number:
Molecular Weight:
159.21
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
97%
form
solid
bp
140 °C/0.5 mmHg
mp
24-28 °C
functional group
nitrile
SMILES string
N#Cc1cc2ccccc2s1
InChI
1S/C9H5NS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-5H
InChI key
RCYHXESNWFYTCU-UHFFFAOYSA-N
Application
Useful starter in benzothiophene chemistry.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2
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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Uwe Koch et al.
Journal of medicinal chemistry, 49(5), 1693-1705 (2006-03-03)
Infections caused by hepatitis C virus (HCV) are a significant world health problem for which novel therapies are in urgent demand. The polymerase of HCV is responsible for the replication of viral RNA. We recently disclosed dihydroxypyrimidine carboxylates 2 as
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