694665
1-(2-Tetrahydropyranyl)-1H-pyrazole
95%
Synonym(s):
1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazole
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About This Item
Empirical Formula (Hill Notation):
C8H12N2O
CAS Number:
Molecular Weight:
152.19
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
95%
Form:
liquid
InChI
1S/C8H12N2O/c1-2-7-11-8(4-1)10-6-3-5-9-10/h3,5-6,8H,1-2,4,7H2
SMILES string
C1CCC(OC1)n2cccn2
InChI key
IMZWSOSYNFVECD-UHFFFAOYSA-N
assay
95%
form
liquid
refractive index
n20/D 1.503
density
1.084 g/mL at 25 °C
functional group
ether
Application
1-THP-protected 1H-pyrazole as the valuable starter for the preparation of pyrazolylboronic ester, which is useful in the synthesis of pyrazoloisoindoles and other pyrazole derivatives
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
219.9 °F
flash_point_c
104.4 °C
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Mary Beth Young et al.
Journal of medicinal chemistry, 47(12), 2995-3008 (2004-05-28)
In an effort to discover potent, clinically useful thrombin inhibitors, a rapid analogue synthetic approach was used to explore the P(1) region. Various benzylamines were coupled to a pyridine/pyrazinone P(2)-P(3) template. One compound with an o-thiadiazole benzylic substitution was found
Tetrahedron Letters, 47, 4665-4665 (2006)
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