2-(4-Methanesulfinyl-phenyl)-[1,3]dioxane

HCID 22057737
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Basic information

Standard SMILES
CS(=O)c1ccc(C2OCCCO2)cc1
InChIKey
BHHLSIILUUEYKB-UHFFFAOYSA-N
Molecular formula
C11H14O3S
Average molar mass
226.29 g/mol

Names & identifiers

Preferred name
2-(4-Methanesulfinyl-phenyl)-[1,3]dioxane
IUPAC
2-(4-methylsulfinylphenyl)-1,3-dioxane

Names & synonyms

SCHEMBL4663122BHHLSIILUUEYKB-UHFFFAOYSA-N2-(4-methanesulfinyl-phenyl)-[1,3]dioxane

Database identifiers

PubChem CID
22057737

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
54.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
15

Related reactions

4 records
New reaction record

Compound notes

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