(3R,4R)-4-thiophen-2-yloxolan-3-ol

C8H10O2S — CID 97036334

IUPAC(3R,4R)-4-thiophen-2-yloxolan-3-ol
SMILESO[C@H]1COC[C@H]1c1cccs1
InChIInChI=1S/C8H10O2S/c9-7-5-10-4-6(7)8-2-1-3-11-8/h1-3,6-7,9H,4-5H2/t6-,7+/m1/s1
InChIKeyDYWRQYDUBQVMFR-RQJHMYQMSA-N
MW170.23 g/mol
LogP1.22
Rot. Bonds1

About (3R,4R)-4-thiophen-2-yloxolan-3-ol

(3R,4R)-4-thiophen-2-yloxolan-3-ol (PubChem CID 97036334) has the molecular formula C8H10O2S and a molecular weight of 170.23 g/mol. Its IUPAC name is (3R,4R)-4-thiophen-2-yloxolan-3-ol.

Molecular Properties

Compound Name(3R,4R)-4-thiophen-2-yloxolan-3-ol
PubChem CID97036334
Molecular FormulaC8H10O2S
Molecular Weight170.23 g/mol
Exact Mass170.04
IUPAC Name(3R,4R)-4-thiophen-2-yloxolan-3-ol
SMILESO[C@H]1COC[C@H]1c1cccs1
InChIInChI=1S/C8H10O2S/c9-7-5-10-4-6(7)8-2-1-3-11-8/h1-3,6-7,9H,4-5H2/t6-,7+/m1/s1
InChIKeyDYWRQYDUBQVMFR-RQJHMYQMSA-N
XLogP1.22
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.23
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-thiophen-2-yloxolan-3-ol?
The IUPAC name of (3R,4R)-4-thiophen-2-yloxolan-3-ol (CID 97036334) is (3R,4R)-4-thiophen-2-yloxolan-3-ol.
What is the SMILES notation for (3R,4R)-4-thiophen-2-yloxolan-3-ol?
The canonical SMILES for (3R,4R)-4-thiophen-2-yloxolan-3-ol is O[C@H]1COC[C@H]1c1cccs1.
What is the InChIKey of (3R,4R)-4-thiophen-2-yloxolan-3-ol?
The InChIKey is DYWRQYDUBQVMFR-RQJHMYQMSA-N. The full InChI is InChI=1S/C8H10O2S/c9-7-5-10-4-6(7)8-2-1-3-11-8/h1-3,6-7,9H,4-5H2/t6-,7+/m1/s1.
What are the key properties of (3R,4R)-4-thiophen-2-yloxolan-3-ol?
(3R,4R)-4-thiophen-2-yloxolan-3-ol has a molecular weight of 170.23 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-thiophen-2-yloxolan-3-ol is sourced from PubChem (CID 97036334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).