2-(4-Bromophenyl)-1-(methylsulfonyl)azetidine

HCID 86698677
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Basic information

Standard SMILES
CS(=O)(=O)N1CCC1c1ccc(Br)cc1
InChIKey
SMVIJSFJMWNQFD-UHFFFAOYSA-N
Molecular formula
C10H12BrNO2S
Average molar mass
290.18 g/mol
Monoisotopic mass
288.97721

Names & identifiers

Preferred name
2-(4-Bromophenyl)-1-(methylsulfonyl)azetidine
IUPAC
2-(4-bromophenyl)-1-methylsulfonylazetidine

Names & synonyms

2-(4-bromophenyl)-1-(methylsulfonyl)azetidine1467060-78-12-(4-bromophenyl)-1-methanesulfonylazetidineSCHEMBL15300758SMVIJSFJMWNQFD-UHFFFAOYSA-NSB51886

Database identifiers

PubChem CID
86698677

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
45.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15

Related reactions

4 records
New reaction record

Compound notes

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