3-(3-hydroxyphenyl)sulfanylphenol

C12H10O2S — CID 14862686

IUPAC3-(3-hydroxyphenyl)sulfanylphenol
SMILESOc1cccc(Sc2cccc(O)c2)c1
InChIInChI=1S/C12H10O2S/c13-9-3-1-5-11(7-9)15-12-6-2-4-10(14)8-12/h1-8,13-14H
InChIKeyGOWCECVOTUONTI-UHFFFAOYSA-N
MW218.28 g/mol
LogP3.25
Rot. Bonds2

About 3-(3-hydroxyphenyl)sulfanylphenol

3-(3-hydroxyphenyl)sulfanylphenol (PubChem CID 14862686) has the molecular formula C12H10O2S and a molecular weight of 218.28 g/mol. Its IUPAC name is 3-(3-hydroxyphenyl)sulfanylphenol.

Molecular Properties

Compound Name3-(3-hydroxyphenyl)sulfanylphenol
PubChem CID14862686
Molecular FormulaC12H10O2S
Molecular Weight218.28 g/mol
Exact Mass218.04
IUPAC Name3-(3-hydroxyphenyl)sulfanylphenol
SMILESOc1cccc(Sc2cccc(O)c2)c1
InChIInChI=1S/C12H10O2S/c13-9-3-1-5-11(7-9)15-12-6-2-4-10(14)8-12/h1-8,13-14H
InChIKeyGOWCECVOTUONTI-UHFFFAOYSA-N
XLogP3.25
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Bisphenol S
CID 6626
4,4'-Thiodiphenol
CID 17570
o-(Methylthio)phenol
CID 61261
4-(Methylthio)phenol
CID 14086
2,4'-Dihydroxydiphenyl sulfone
CID 79381
4,4'-Thiodiresorcinol
CID 66802
4-[(4-Hydroxyphenyl)disulfanyl]phenol
CID 280665
Phenol, 2,2'-thiobis-
CID 83665
2-(Phenylsulfonyl)-1,4-benzenediol
CID 640910
4-(Methylsulfinyl)phenol
CID 151936
4-(Benzenesulfonyl)phenol
CID 343804
2-(Ethylthio)phenol
CID 122407

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxyphenyl)sulfanylphenol?
The IUPAC name of 3-(3-hydroxyphenyl)sulfanylphenol (CID 14862686) is 3-(3-hydroxyphenyl)sulfanylphenol.
What is the SMILES notation for 3-(3-hydroxyphenyl)sulfanylphenol?
The canonical SMILES for 3-(3-hydroxyphenyl)sulfanylphenol is Oc1cccc(Sc2cccc(O)c2)c1.
What is the InChIKey of 3-(3-hydroxyphenyl)sulfanylphenol?
The InChIKey is GOWCECVOTUONTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O2S/c13-9-3-1-5-11(7-9)15-12-6-2-4-10(14)8-12/h1-8,13-14H.
What are the key properties of 3-(3-hydroxyphenyl)sulfanylphenol?
3-(3-hydroxyphenyl)sulfanylphenol has a molecular weight of 218.28 g/mol, XLogP of 3.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxyphenyl)sulfanylphenol is sourced from PubChem (CID 14862686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).