2,3-bis(oxiran-2-ylmethoxymethyl)furan

C12H16O5 — CID 176654552

IUPAC2,3-bis(oxiran-2-ylmethoxymethyl)furan
SMILESc1cc(COCC2CO2)c(COCC2CO2)o1
InChIInChI=1S/C12H16O5/c1-2-15-12(8-14-5-11-7-17-11)9(1)3-13-4-10-6-16-10/h1-2,10-11H,3-8H2
InChIKeyZLDJRHNMZKNVCH-UHFFFAOYSA-N
MW240.25 g/mol
LogP1.11
Rot. Bonds8

About 2,3-bis(oxiran-2-ylmethoxymethyl)furan

2,3-bis(oxiran-2-ylmethoxymethyl)furan (PubChem CID 176654552) has the molecular formula C12H16O5 and a molecular weight of 240.25 g/mol. Its IUPAC name is 2,3-bis(oxiran-2-ylmethoxymethyl)furan.

Molecular Properties

Compound Name2,3-bis(oxiran-2-ylmethoxymethyl)furan
PubChem CID176654552
Molecular FormulaC12H16O5
Molecular Weight240.25 g/mol
Exact Mass240.10
IUPAC Name2,3-bis(oxiran-2-ylmethoxymethyl)furan
SMILESc1cc(COCC2CO2)c(COCC2CO2)o1
InChIInChI=1S/C12H16O5/c1-2-15-12(8-14-5-11-7-17-11)9(1)3-13-4-10-6-16-10/h1-2,10-11H,3-8H2
InChIKeyZLDJRHNMZKNVCH-UHFFFAOYSA-N
XLogP1.11
TPSA56.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.25
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[[2,4,5-tris(oxiran-2-ylmethoxymethyl)phenyl]methoxymethyl]oxirane
CID 139993716
[3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine
CID 62444972
[3-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
CID 62443550
(2R)-2-[(2,4,5-trifluorophenyl)methoxymethyl]oxirane
CID 97180096
N-[[2-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444616
2-[[2,3-bis(oxiran-2-ylmethoxymethyl)phenyl]methoxymethyl]oxirane;ethene
CID 159741748
5-[[(2S)-oxiran-2-yl]methoxymethyl]-2-[[(2R)-oxiran-2-yl]methoxymethyl]furan
CID 134445113
2-methyl-N-[[2-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 62444617
bis(benzene-1,4-diol);2-(oxiran-2-ylmethoxymethyl)oxirane
CID 158653156
2-methyl-N-[[2-(oxan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 62444899
2-[[4-[[4-[[4-(oxiran-2-ylmethoxymethyl)phenyl]methyl]phenyl]methyl]phenyl]methoxymethyl]oxirane
CID 146491565
(2R)-2-[(2,3-dichlorophenyl)methoxymethyl]oxirane
CID 97180060

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(oxiran-2-ylmethoxymethyl)furan?
The IUPAC name of 2,3-bis(oxiran-2-ylmethoxymethyl)furan (CID 176654552) is 2,3-bis(oxiran-2-ylmethoxymethyl)furan.
What is the SMILES notation for 2,3-bis(oxiran-2-ylmethoxymethyl)furan?
The canonical SMILES for 2,3-bis(oxiran-2-ylmethoxymethyl)furan is c1cc(COCC2CO2)c(COCC2CO2)o1.
What is the InChIKey of 2,3-bis(oxiran-2-ylmethoxymethyl)furan?
The InChIKey is ZLDJRHNMZKNVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O5/c1-2-15-12(8-14-5-11-7-17-11)9(1)3-13-4-10-6-16-10/h1-2,10-11H,3-8H2.
What are the key properties of 2,3-bis(oxiran-2-ylmethoxymethyl)furan?
2,3-bis(oxiran-2-ylmethoxymethyl)furan has a molecular weight of 240.25 g/mol, XLogP of 1.11, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(oxiran-2-ylmethoxymethyl)furan is sourced from PubChem (CID 176654552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).