3-(4-Chloro-benzenesulfonyl)-3-(2,3,6-trifluoro-phenyl)-propan-1-ol

HCID 58950508
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Basic information

Standard SMILES
O=S(=O)(c1ccc(Cl)cc1)C(CCO)c1c(F)ccc(F)c1F
InChIKey
HRNSBSNRNNEGJO-UHFFFAOYSA-N
Molecular formula
C15H12ClF3O3S
Average molar mass
364.8 g/mol

Names & identifiers

Preferred name
3-(4-Chloro-benzenesulfonyl)-3-(2,3,6-trifluoro-phenyl)-propan-1-ol
IUPAC
3-(4-chlorophenyl)sulfonyl-3-(2,3,6-trifluorophenyl)propan-1-ol

Names & synonyms

SCHEMBL1364598HRNSBSNRNNEGJO-UHFFFAOYSA-N3-(4-Chloro-benzenesulfonyl)-3-(2,3,6-trifluoro-phenyl)-propan-1-ol

Database identifiers

PubChem CID
58950508

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
62.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
23

Related reactions

3 records
New reaction record

Compound notes

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