(3R)-thiolan-3-ol

C4H8OS — CID 10011856

IUPAC(3R)-thiolan-3-ol
SMILESO[C@@H]1CCSC1
InChIInChI=1S/C4H8OS/c5-4-1-2-6-3-4/h4-5H,1-3H2/t4-/m1/s1
InChIKeyBJYXNFYVCZIXQC-SCSAIBSYSA-N
MW104.17 g/mol
LogP0.48
Rot. Bonds

About (3R)-thiolan-3-ol

(3R)-thiolan-3-ol (PubChem CID 10011856) has the molecular formula C4H8OS and a molecular weight of 104.17 g/mol. Its IUPAC name is (3R)-thiolan-3-ol.

Molecular Properties

Compound Name(3R)-thiolan-3-ol
PubChem CID10011856
Molecular FormulaC4H8OS
Molecular Weight104.17 g/mol
Exact Mass104.03
IUPAC Name(3R)-thiolan-3-ol
SMILESO[C@@H]1CCSC1
InChIInChI=1S/C4H8OS/c5-4-1-2-6-3-4/h4-5H,1-3H2/t4-/m1/s1
InChIKeyBJYXNFYVCZIXQC-SCSAIBSYSA-N
XLogP0.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.17
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-thiolan-3-ol?
The IUPAC name of (3R)-thiolan-3-ol (CID 10011856) is (3R)-thiolan-3-ol.
What is the SMILES notation for (3R)-thiolan-3-ol?
The canonical SMILES for (3R)-thiolan-3-ol is O[C@@H]1CCSC1.
What is the InChIKey of (3R)-thiolan-3-ol?
The InChIKey is BJYXNFYVCZIXQC-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H8OS/c5-4-1-2-6-3-4/h4-5H,1-3H2/t4-/m1/s1.
What are the key properties of (3R)-thiolan-3-ol?
(3R)-thiolan-3-ol has a molecular weight of 104.17 g/mol, XLogP of 0.48, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-thiolan-3-ol is sourced from PubChem (CID 10011856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).