4-(4-ethoxyphenyl)sulfinylphenol

C14H14O3S — CID 139983404

IUPAC4-(4-ethoxyphenyl)sulfinylphenol
SMILESCCOc1ccc(S(=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C14H14O3S/c1-2-17-12-5-9-14(10-6-12)18(16)13-7-3-11(15)4-8-13/h3-10,15H,2H2,1H3
InChIKeyOZAFDSCIGPEXKL-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.96
Rot. Bonds4

About 4-(4-ethoxyphenyl)sulfinylphenol

4-(4-ethoxyphenyl)sulfinylphenol (PubChem CID 139983404) has the molecular formula C14H14O3S and a molecular weight of 262.33 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)sulfinylphenol.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)sulfinylphenol
PubChem CID139983404
Molecular FormulaC14H14O3S
Molecular Weight262.33 g/mol
Exact Mass262.07
IUPAC Name4-(4-ethoxyphenyl)sulfinylphenol
SMILESCCOc1ccc(S(=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C14H14O3S/c1-2-17-12-5-9-14(10-6-12)18(16)13-7-3-11(15)4-8-13/h3-10,15H,2H2,1H3
InChIKeyOZAFDSCIGPEXKL-UHFFFAOYSA-N
XLogP2.96
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethoxyphenol isocyanate
CID 20557311
4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol
CID 142764028
4-[4-(trichloromethoxy)phenyl]sulfinylphenol
CID 21200827
sodium;chloroethane;1-ethoxy-4-methoxybenzene;4-methoxyphenol;hydroxide
CID 159331010
4-[4-[7-[4-(4-ethoxyphenyl)sulfonylphenoxy]heptoxy]phenyl]sulfonylphenol
CID 139963527
4-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 13388921
1-ethoxy-4-phenylbenzene;phenol
CID 174652155
N-[2-(4-ethoxyphenyl)ethyl]-3-(4-hydroxyphenyl)propanamide
CID 174483925
1-(2,4-dihydroxyphenyl)-2-(4-ethoxyphenoxy)ethanone
CID 678669
4-[(4-ethoxyanilino)methyl]phenol
CID 3271066
ethane;1-ethoxy-4-nitrobenzene;methane;1-methoxy-4-nitrobenzene;4-nitrophenol
CID 158868272
4-ethoxy-N'-[2-(4-hydroxyphenyl)acetyl]benzohydrazide
CID 78821862

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)sulfinylphenol?
The IUPAC name of 4-(4-ethoxyphenyl)sulfinylphenol (CID 139983404) is 4-(4-ethoxyphenyl)sulfinylphenol.
What is the SMILES notation for 4-(4-ethoxyphenyl)sulfinylphenol?
The canonical SMILES for 4-(4-ethoxyphenyl)sulfinylphenol is CCOc1ccc(S(=O)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)sulfinylphenol?
The InChIKey is OZAFDSCIGPEXKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O3S/c1-2-17-12-5-9-14(10-6-12)18(16)13-7-3-11(15)4-8-13/h3-10,15H,2H2,1H3.
What are the key properties of 4-(4-ethoxyphenyl)sulfinylphenol?
4-(4-ethoxyphenyl)sulfinylphenol has a molecular weight of 262.33 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)sulfinylphenol is sourced from PubChem (CID 139983404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).