(2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane

C8H14O3 — CID 92982921

IUPAC(2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane
SMILESC1CC[C@H](OC[C@H]2CO2)OC1
InChIInChI=1S/C8H14O3/c1-2-4-9-8(3-1)11-6-7-5-10-7/h7-8H,1-6H2/t7-,8+/m1/s1
InChIKeyFSJPDLYSFQMHHV-SFYZADRCSA-N
MW158.20 g/mol
LogP0.93
Rot. Bonds3

About (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane

(2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane (PubChem CID 92982921) has the molecular formula C8H14O3 and a molecular weight of 158.20 g/mol. Its IUPAC name is (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane.

Molecular Properties

Compound Name(2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane
PubChem CID92982921
Molecular FormulaC8H14O3
Molecular Weight158.20 g/mol
Exact Mass158.09
IUPAC Name(2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane
SMILESC1CC[C@H](OC[C@H]2CO2)OC1
InChIInChI=1S/C8H14O3/c1-2-4-9-8(3-1)11-6-7-5-10-7/h7-8H,1-6H2/t7-,8+/m1/s1
InChIKeyFSJPDLYSFQMHHV-SFYZADRCSA-N
XLogP0.93
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-bromooxolan-2-yl)methoxy]oxane
CID 11277076
2-[5-(oxiran-2-yl)pentoxy]oxane
CID 169009121
2-[6-(oxiran-2-yl)hexoxy]oxane
CID 177274031
(2R)-2-[[(1R,2S)-2-[[(2S)-oxiran-2-yl]methoxy]cyclohexyl]oxymethyl]oxirane
CID 129448945
2-[(E)-4-(oxan-2-yloxy)but-2-enoxy]oxane
CID 14103518
(3R)-3-(oxan-2-yloxymethyl)-3,6-dihydro-2H-pyran
CID 11241051
(4S)-4-(oxan-2-yloxymethyl)-1,3-oxazolidin-2-one
CID 44604239
2-[(2E,4E)-6-(oxan-2-yloxy)hexa-2,4-dienoxy]oxane
CID 14026777
2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane
CID 155771365
magnesium;2-ethoxyoxane;dichloride
CID 158421621
zinc 2-(3-bromopropoxy)oxane
CID 175895645
2-(cyclohex-3-en-1-ylmethoxy)oxane
CID 12025488

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane?
The IUPAC name of (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane (CID 92982921) is (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane.
What is the SMILES notation for (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane?
The canonical SMILES for (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane is C1CC[C@H](OC[C@H]2CO2)OC1.
What is the InChIKey of (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane?
The InChIKey is FSJPDLYSFQMHHV-SFYZADRCSA-N. The full InChI is InChI=1S/C8H14O3/c1-2-4-9-8(3-1)11-6-7-5-10-7/h7-8H,1-6H2/t7-,8+/m1/s1.
What are the key properties of (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane?
(2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane has a molecular weight of 158.20 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[[(2R)-oxiran-2-yl]methoxy]oxane is sourced from PubChem (CID 92982921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).