(4-methylsulfanylphenyl)methanol

C8H10OS — CID 592968

IUPAC(4-methylsulfanylphenyl)methanol
SMILESCSc1ccc(CO)cc1
InChIInChI=1S/C8H10OS/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3
InChIKeyMTXQKSQYMREAGJ-UHFFFAOYSA-N
MW154.23 g/mol
LogP1.90
Rot. Bonds2

About (4-methylsulfanylphenyl)methanol

(4-methylsulfanylphenyl)methanol (PubChem CID 592968) has the molecular formula C8H10OS and a molecular weight of 154.23 g/mol. Its IUPAC name is (4-methylsulfanylphenyl)methanol.

Molecular Properties

Compound Name(4-methylsulfanylphenyl)methanol
PubChem CID592968
Molecular FormulaC8H10OS
Molecular Weight154.23 g/mol
Exact Mass154.05
IUPAC Name(4-methylsulfanylphenyl)methanol
SMILESCSc1ccc(CO)cc1
InChIInChI=1S/C8H10OS/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3
InChIKeyMTXQKSQYMREAGJ-UHFFFAOYSA-N
XLogP1.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.23
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-methylsulfanylphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-methylsulfanylphenyl)methanol?
The IUPAC name of (4-methylsulfanylphenyl)methanol (CID 592968) is (4-methylsulfanylphenyl)methanol.
What is the SMILES notation for (4-methylsulfanylphenyl)methanol?
The canonical SMILES for (4-methylsulfanylphenyl)methanol is CSc1ccc(CO)cc1.
What is the InChIKey of (4-methylsulfanylphenyl)methanol?
The InChIKey is MTXQKSQYMREAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10OS/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3.
What are the key properties of (4-methylsulfanylphenyl)methanol?
(4-methylsulfanylphenyl)methanol has a molecular weight of 154.23 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylsulfanylphenyl)methanol is sourced from PubChem (CID 592968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).