2-(benzenesulfonyl)prop-2-enoxybenzene

C15H14O3S — CID 138971446

IUPAC2-(benzenesulfonyl)prop-2-enoxybenzene
SMILESC=C(COc1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C15H14O3S/c1-13(12-18-14-8-4-2-5-9-14)19(16,17)15-10-6-3-7-11-15/h2-11H,1,12H2
InChIKeyUFCIWWJIKGFSTB-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.05
Rot. Bonds5

About 2-(benzenesulfonyl)prop-2-enoxybenzene

2-(benzenesulfonyl)prop-2-enoxybenzene (PubChem CID 138971446) has the molecular formula C15H14O3S and a molecular weight of 274.34 g/mol. Its IUPAC name is 2-(benzenesulfonyl)prop-2-enoxybenzene.

Molecular Properties

Compound Name2-(benzenesulfonyl)prop-2-enoxybenzene
PubChem CID138971446
Molecular FormulaC15H14O3S
Molecular Weight274.34 g/mol
Exact Mass274.07
IUPAC Name2-(benzenesulfonyl)prop-2-enoxybenzene
SMILESC=C(COc1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C15H14O3S/c1-13(12-18-14-8-4-2-5-9-14)19(16,17)15-10-6-3-7-11-15/h2-11H,1,12H2
InChIKeyUFCIWWJIKGFSTB-UHFFFAOYSA-N
XLogP3.05
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzenesulfonyl)prop-2-enyl acetate
CID 91999686
[4-(benzenesulfonyl)-2,2-bis(benzenesulfonyloxymethyl)pent-4-enyl] benzenesulfonate
CID 89088812
2-phenoxyacetic acid;titanium
CID 174896747
1-(benzenesulfonyl)-3-phenoxy-1-phenylpropan-2-one
CID 166437676
dimethyl 2-[2-(benzenesulfonyl)prop-2-enyl]propanedioate
CID 10638838
3-phenoxy-2-sulfanylidenepropanoic acid
CID 54414786
1-[2-(benzenesulfonyl)prop-2-enylsulfonyl]-4-methylbenzene
CID 40578886
magnesium;hydride;2-phenoxyacetic acid
CID 173069745
2-oxo-3-phenoxypropanoic acid
CID 18994126
2-(benzenesulfinyl)prop-2-enoxybenzene
CID 14321115
chlorosulfonyl 2-phenoxyacetate
CID 87253994
1-(benzenesulfonylmethyl)-2-(phenoxymethyl)benzene
CID 90995304

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)prop-2-enoxybenzene?
The IUPAC name of 2-(benzenesulfonyl)prop-2-enoxybenzene (CID 138971446) is 2-(benzenesulfonyl)prop-2-enoxybenzene.
What is the SMILES notation for 2-(benzenesulfonyl)prop-2-enoxybenzene?
The canonical SMILES for 2-(benzenesulfonyl)prop-2-enoxybenzene is C=C(COc1ccccc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-(benzenesulfonyl)prop-2-enoxybenzene?
The InChIKey is UFCIWWJIKGFSTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3S/c1-13(12-18-14-8-4-2-5-9-14)19(16,17)15-10-6-3-7-11-15/h2-11H,1,12H2.
What are the key properties of 2-(benzenesulfonyl)prop-2-enoxybenzene?
2-(benzenesulfonyl)prop-2-enoxybenzene has a molecular weight of 274.34 g/mol, XLogP of 3.05, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)prop-2-enoxybenzene is sourced from PubChem (CID 138971446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).