Methyl 1-(3-chloropyridin-2-yl)-3-{[(methylsulfonyl)oxy]methyl}-1H-pyrazole-5-carboxylate

HCID 58320697

Basic information

Standard SMILES
COC(=O)c1cc(COS(C)(=O)=O)nn1-c1ncccc1Cl
InChIKey
IPOVQEQJGOGWFT-UHFFFAOYSA-N
Molecular formula
C12H12ClN3O5S
Average molar mass
345.76 g/mol

Names & identifiers

Preferred name
Methyl 1-(3-chloropyridin-2-yl)-3-{[(methylsulfonyl)oxy]methyl}-1H-pyrazole-5-carboxylate
IUPAC
methyl 1-(3-chloro-2-pyridinyl)-3-(methylsulfonyloxymethyl)pyrazole-5-carboxylate

Names & synonyms

SCHEMBL384668IPOVQEQJGOGWFT-UHFFFAOYSA-NMethyl 1-(3-chloropyridin-2-yl)-3-{[(methylsulfonyl)oxy]methyl}-1H-pyrazole-5-carboxylatemethyl 2-(3-chloropyridin-2-yl)-5-methane-sulphonyloxymethyl-2H-pyrazole-3-carboxylateMethyl 2-(3-chloropyridin-2-yl)-5-methanesulphonyloxymethyl-2H-pyrazole-3-carboxylate

Database identifiers

PubChem CID
58320697

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
109 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
22

Related reactions

9 records

Compound notes

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