2-[(3-Fluorophenyl)methoxy]-5-methylbenzene-1-sulfonyl chloride
Basic information
- CAS
1016534-69-2- Standard SMILES
Cc1ccc(OCc2cccc(F)c2)c(S(=O)(=O)Cl)c1- InChIKey
XPVWLGROUGOIAO-UHFFFAOYSA-N- Molecular formula
- C14H12ClFO3S
- Average molar mass
- 314.8 g/mol
- Monoisotopic mass
- 314.0179713
Names & identifiers
- Preferred name
- 2-[(3-Fluorophenyl)methoxy]-5-methylbenzene-1-sulfonyl chloride
- IUPAC
- 2-[(3-fluorophenyl)methoxy]-5-methylbenzenesulfonyl chloride
Names & synonyms
DTXSID0011852112-[(3-FLUOROPHENYL)METHOXY]-5-METHYLBENZENE-1-SULFONYL CHLORIDEAKOS0001596762-[(3-fluorophenyl)methoxy]-5-methylbenzenesulfonyl chloride1016534-69-2
Database identifiers
- CAS
1016534-69-2- PubChem CID
- 20120127
- DTXSID
DTXSID001185211
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 409
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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