2-(methylsulfinylmethoxymethyl)phenol

C9H12O3S — CID 134936819

IUPAC2-(methylsulfinylmethoxymethyl)phenol
SMILESCS(=O)COCc1ccccc1O
InChIInChI=1S/C9H12O3S/c1-13(11)7-12-6-8-4-2-3-5-9(8)10/h2-5,10H,6-7H2,1H3
InChIKeyUDSXAOJVIASERY-UHFFFAOYSA-N
MW200.26 g/mol
LogP1.24
Rot. Bonds4

About 2-(methylsulfinylmethoxymethyl)phenol

2-(methylsulfinylmethoxymethyl)phenol (PubChem CID 134936819) has the molecular formula C9H12O3S and a molecular weight of 200.26 g/mol. Its IUPAC name is 2-(methylsulfinylmethoxymethyl)phenol.

Molecular Properties

Compound Name2-(methylsulfinylmethoxymethyl)phenol
PubChem CID134936819
Molecular FormulaC9H12O3S
Molecular Weight200.26 g/mol
Exact Mass200.05
IUPAC Name2-(methylsulfinylmethoxymethyl)phenol
SMILESCS(=O)COCc1ccccc1O
InChIInChI=1S/C9H12O3S/c1-13(11)7-12-6-8-4-2-3-5-9(8)10/h2-5,10H,6-7H2,1H3
InChIKeyUDSXAOJVIASERY-UHFFFAOYSA-N
XLogP1.24
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyethoxymethyl)phenol
CID 21397612
2-(2-ethylsilyloxyethoxymethyl)phenol
CID 154022719
2-(2-methoxyethoxymethoxymethyl)phenol
CID 23251146
benzene;2-ethylphenol
CID 159726745
CID 140892716
CID 140892716
(2-hydroxyphenyl)methyl 2-methylpropanimidate
CID 58806992
diethyl (2-hydroxyphenyl)methyl phosphate
CID 174892614
magnesium;2-ethylphenol;chloride
CID 173391731
2-(triethylsilyloxymethyl)phenol
CID 12672316
2-(2-amino-2-methylpropyl)phenol
CID 22723438
2-(methoxymethyl)phenol;(2-methoxyphenyl)methanol
CID 138113041
CID 147052016
CID 147052016

Frequently Asked Questions

What is the IUPAC name of 2-(methylsulfinylmethoxymethyl)phenol?
The IUPAC name of 2-(methylsulfinylmethoxymethyl)phenol (CID 134936819) is 2-(methylsulfinylmethoxymethyl)phenol.
What is the SMILES notation for 2-(methylsulfinylmethoxymethyl)phenol?
The canonical SMILES for 2-(methylsulfinylmethoxymethyl)phenol is CS(=O)COCc1ccccc1O.
What is the InChIKey of 2-(methylsulfinylmethoxymethyl)phenol?
The InChIKey is UDSXAOJVIASERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O3S/c1-13(11)7-12-6-8-4-2-3-5-9(8)10/h2-5,10H,6-7H2,1H3.
What are the key properties of 2-(methylsulfinylmethoxymethyl)phenol?
2-(methylsulfinylmethoxymethyl)phenol has a molecular weight of 200.26 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylsulfinylmethoxymethyl)phenol is sourced from PubChem (CID 134936819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).