(2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol

C15H16O2S — CID 114978739

IUPAC(2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol
SMILESCOc1ccccc1C(O)c1ccccc1SC
InChIInChI=1S/C15H16O2S/c1-17-13-9-5-3-7-11(13)15(16)12-8-4-6-10-14(12)18-2/h3-10,15-16H,1-2H3
InChIKeyRLDZCSPMPYVEEX-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.50
Rot. Bonds4

About (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol

(2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol (PubChem CID 114978739) has the molecular formula C15H16O2S and a molecular weight of 260.36 g/mol. Its IUPAC name is (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol.

Molecular Properties

Compound Name(2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol
PubChem CID114978739
Molecular FormulaC15H16O2S
Molecular Weight260.36 g/mol
Exact Mass260.09
IUPAC Name(2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol
SMILESCOc1ccccc1C(O)c1ccccc1SC
InChIInChI=1S/C15H16O2S/c1-17-13-9-5-3-7-11(13)15(16)12-8-4-6-10-14(12)18-2/h3-10,15-16H,1-2H3
InChIKeyRLDZCSPMPYVEEX-UHFFFAOYSA-N
XLogP3.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,5-difluorophenyl)-(2-methoxyphenyl)methanol
CID 61100106
(2-chloro-4,5-dimethylphenyl)-(2-methylsulfanylphenyl)methanol
CID 115484546
[4-(difluoromethyl)phenyl]-(2-methoxyphenyl)methanol
CID 115525064
(4-iodophenyl)-(2-methoxyphenyl)methanol
CID 114978781
1-(2-fluoro-3-methoxyphenyl)-N-methyl-1-(2-methylsulfanylphenyl)methanamine
CID 105025159
(2-aminophenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82807791
(2,5-dichlorophenyl)-(2-methoxyphenyl)methanol
CID 61082800
1-[2-(2-methoxyphenyl)sulfanylphenyl]ethanol
CID 63835196
2-methyl-1-(2-methylsulfanylphenyl)propan-1-ol
CID 115840237
2-fluoro-1-methoxy-3-methylsulfanylbenzene
CID 91881055
(R)-(2-methylsulfanylphenyl)-pyridin-2-ylmethanol
CID 97292943
(2,4-dichloropyrimidin-5-yl)-(2-methoxyphenyl)methanol
CID 59753866

Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol?
The IUPAC name of (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol (CID 114978739) is (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol.
What is the SMILES notation for (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol?
The canonical SMILES for (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol is COc1ccccc1C(O)c1ccccc1SC.
What is the InChIKey of (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol?
The InChIKey is RLDZCSPMPYVEEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2S/c1-17-13-9-5-3-7-11(13)15(16)12-8-4-6-10-14(12)18-2/h3-10,15-16H,1-2H3.
What are the key properties of (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol?
(2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol has a molecular weight of 260.36 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl)-(2-methylsulfanylphenyl)methanol is sourced from PubChem (CID 114978739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).