2-methylsulfanylcyclobutan-1-ol

C5H10OS — CID 155970669

IUPAC2-methylsulfanylcyclobutan-1-ol
SMILESCSC1CCC1O
InChIInChI=1S/C5H10OS/c1-7-5-3-2-4(5)6/h4-6H,2-3H2,1H3
InChIKeyFAUKVWMNPKIYAV-UHFFFAOYSA-N
MW118.20 g/mol
LogP0.87
Rot. Bonds1

About 2-methylsulfanylcyclobutan-1-ol

2-methylsulfanylcyclobutan-1-ol (PubChem CID 155970669) has the molecular formula C5H10OS and a molecular weight of 118.20 g/mol. Its IUPAC name is 2-methylsulfanylcyclobutan-1-ol.

Molecular Properties

Compound Name2-methylsulfanylcyclobutan-1-ol
PubChem CID155970669
Molecular FormulaC5H10OS
Molecular Weight118.20 g/mol
Exact Mass118.05
IUPAC Name2-methylsulfanylcyclobutan-1-ol
SMILESCSC1CCC1O
InChIInChI=1S/C5H10OS/c1-7-5-3-2-4(5)6/h4-6H,2-3H2,1H3
InChIKeyFAUKVWMNPKIYAV-UHFFFAOYSA-N
XLogP0.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.20
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methylsulfanylcyclobutan-1-ol?
The IUPAC name of 2-methylsulfanylcyclobutan-1-ol (CID 155970669) is 2-methylsulfanylcyclobutan-1-ol.
What is the SMILES notation for 2-methylsulfanylcyclobutan-1-ol?
The canonical SMILES for 2-methylsulfanylcyclobutan-1-ol is CSC1CCC1O.
What is the InChIKey of 2-methylsulfanylcyclobutan-1-ol?
The InChIKey is FAUKVWMNPKIYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10OS/c1-7-5-3-2-4(5)6/h4-6H,2-3H2,1H3.
What are the key properties of 2-methylsulfanylcyclobutan-1-ol?
2-methylsulfanylcyclobutan-1-ol has a molecular weight of 118.20 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfanylcyclobutan-1-ol is sourced from PubChem (CID 155970669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).