(R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol

C7H8O2S — CID 131018320

IUPAC(R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol
SMILESO[C@H](c1ccsc1)[C@H]1CO1
InChIInChI=1S/C7H8O2S/c8-7(6-3-9-6)5-1-2-10-4-5/h1-2,4,6-8H,3H2/t6-,7-/m1/s1
InChIKeyZRWVOWNEPXHSHI-RNFRBKRXSA-N
MW156.21 g/mol
LogP1.18
Rot. Bonds2

About (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol

(R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol (PubChem CID 131018320) has the molecular formula C7H8O2S and a molecular weight of 156.21 g/mol. Its IUPAC name is (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol.

Molecular Properties

Compound Name(R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol
PubChem CID131018320
Molecular FormulaC7H8O2S
Molecular Weight156.21 g/mol
Exact Mass156.02
IUPAC Name(R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol
SMILESO[C@H](c1ccsc1)[C@H]1CO1
InChIInChI=1S/C7H8O2S/c8-7(6-3-9-6)5-1-2-10-4-5/h1-2,4,6-8H,3H2/t6-,7-/m1/s1
InChIKeyZRWVOWNEPXHSHI-RNFRBKRXSA-N
XLogP1.18
TPSA32.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol?
The IUPAC name of (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol (CID 131018320) is (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol.
What is the SMILES notation for (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol?
The canonical SMILES for (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol is O[C@H](c1ccsc1)[C@H]1CO1.
What is the InChIKey of (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol?
The InChIKey is ZRWVOWNEPXHSHI-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H8O2S/c8-7(6-3-9-6)5-1-2-10-4-5/h1-2,4,6-8H,3H2/t6-,7-/m1/s1.
What are the key properties of (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol?
(R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol has a molecular weight of 156.21 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-[(2R)-oxiran-2-yl]-thiophen-3-ylmethanol is sourced from PubChem (CID 131018320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).