4-(2-Butynyloxy)-6-methanesulfonylpyrimidine

HCID 22599863
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Basic information

Standard SMILES
CC#CCOc1cc(S(C)(=O)=O)ncn1
InChIKey
XCVCLNAIZNWKAB-UHFFFAOYSA-N
Molecular formula
C9H10N2O3S
Average molar mass
226.25 g/mol

Names & identifiers

Preferred name
4-(2-Butynyloxy)-6-methanesulfonylpyrimidine
IUPAC
4-but-2-ynoxy-6-methylsulfonylpyrimidine

Names & synonyms

SCHEMBL5408029XCVCLNAIZNWKAB-UHFFFAOYSA-N4-(2-butynyloxy)-6-methanesulfonylpyrimidine

Database identifiers

PubChem CID
22599863

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
77.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
15

Related reactions

8 records
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Compound notes

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