4-Bromo-2-(4,5-dihydroisoxazol-3-yl)-3-methylbenzenesulfonyl chloride

HCID 18757253

Basic information

Standard SMILES
Cc1c(Br)ccc(S(=O)(=O)Cl)c1C1=NOCC1
InChIKey
SMXHZTOAOGFHJJ-UHFFFAOYSA-N
Molecular formula
C10H9BrClNO3S
Average molar mass
338.61 g/mol

Names & identifiers

Preferred name
4-Bromo-2-(4,5-dihydroisoxazol-3-yl)-3-methylbenzenesulfonyl chloride
IUPAC
4-bromo-2-(4,5-dihydro-1,2-oxazol-3-yl)-3-methylbenzenesulfonyl chloride

Names & synonyms

SCHEMBL700999SMXHZTOAOGFHJJ-UHFFFAOYSA-N4-bromo-2-(4,5-dihydroisoxazol-3-yl)-3-methyl-benzenesulfonyl Chloride4-bromo-2-(4,5-dihydroisoxazol-3-yl)-3-methylbenzenesulfonyl chloride

Database identifiers

PubChem CID
18757253

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
64.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
17

Related reactions

10 records

Linked notes

Loading…