4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride

C10H10ClFO3S — CID 84729733

IUPAC4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(C2(F)CCOC2)cc1
InChIInChI=1S/C10H10ClFO3S/c11-16(13,14)9-3-1-8(2-4-9)10(12)5-6-15-7-10/h1-4H,5-7H2
InChIKeyHWOXCUZMUPYUOD-UHFFFAOYSA-N
MW264.70 g/mol
LogP2.20
Rot. Bonds2

About 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride

4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride (PubChem CID 84729733) has the molecular formula C10H10ClFO3S and a molecular weight of 264.70 g/mol. Its IUPAC name is 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride.

Molecular Properties

Compound Name4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride
PubChem CID84729733
Molecular FormulaC10H10ClFO3S
Molecular Weight264.70 g/mol
Exact Mass264.00
IUPAC Name4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(C2(F)CCOC2)cc1
InChIInChI=1S/C10H10ClFO3S/c11-16(13,14)9-3-1-8(2-4-9)10(12)5-6-15-7-10/h1-4H,5-7H2
InChIKeyHWOXCUZMUPYUOD-UHFFFAOYSA-N
XLogP2.20
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.70
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride?
The IUPAC name of 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride (CID 84729733) is 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride.
What is the SMILES notation for 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride?
The canonical SMILES for 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride is O=S(=O)(Cl)c1ccc(C2(F)CCOC2)cc1.
What is the InChIKey of 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride?
The InChIKey is HWOXCUZMUPYUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFO3S/c11-16(13,14)9-3-1-8(2-4-9)10(12)5-6-15-7-10/h1-4H,5-7H2.
What are the key properties of 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride?
4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride has a molecular weight of 264.70 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorooxolan-3-yl)benzenesulfonyl chloride is sourced from PubChem (CID 84729733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).