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1-Benzenesulfonyl-2-vinylpyrrolidine

HCID 68839934
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=CC1CCCN1S(=O)(=O)c1ccccc1
InChIKey
XZENCVDGWAYDFL-UHFFFAOYSA-N
Molecular formula
C12H15NO2S
Average molar mass
237.32 g/mol

Names & identifiers

Preferred name
1-Benzenesulfonyl-2-vinylpyrrolidine
IUPAC
1-(benzenesulfonyl)-2-ethenylpyrrolidine

Names & synonyms

SCHEMBL3920618XZENCVDGWAYDFL-UHFFFAOYSA-N1-Benzenesulfonyl-2-vinylpyrrolidine2-Ethenyl-1-(phenylsulfonyl)pyrrolidineDB-3931101057340-64-3

Database identifiers

PubChem CID
68839934

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
45.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
339

Related reactions

4 records
New reaction record
HRID 152897 reaction equation
HRID 152897As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 168564 reaction equation
HRID 168564As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 660653 reaction equation
HRID 660653As productuspto-grants-2011_12
HRID 660654 reaction equation
HRID 660654As reactantuspto-grants-2011_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes