2,3,5-trimethoxy-2,5-dihydrofuran

C7H12O4 — CID 12521517

IUPAC2,3,5-trimethoxy-2,5-dihydrofuran
SMILESCOC1=CC(OC)OC1OC
InChIInChI=1S/C7H12O4/c1-8-5-4-6(9-2)11-7(5)10-3/h4,6-7H,1-3H3
InChIKeyHZDOLPOBCDTTPC-UHFFFAOYSA-N
MW160.17 g/mol
LogP0.49
Rot. Bonds3

About 2,3,5-trimethoxy-2,5-dihydrofuran

2,3,5-trimethoxy-2,5-dihydrofuran (PubChem CID 12521517) has the molecular formula C7H12O4 and a molecular weight of 160.17 g/mol. Its IUPAC name is 2,3,5-trimethoxy-2,5-dihydrofuran.

Molecular Properties

Compound Name2,3,5-trimethoxy-2,5-dihydrofuran
PubChem CID12521517
Molecular FormulaC7H12O4
Molecular Weight160.17 g/mol
Exact Mass160.07
IUPAC Name2,3,5-trimethoxy-2,5-dihydrofuran
SMILESCOC1=CC(OC)OC1OC
InChIInChI=1S/C7H12O4/c1-8-5-4-6(9-2)11-7(5)10-3/h4,6-7H,1-3H3
InChIKeyHZDOLPOBCDTTPC-UHFFFAOYSA-N
XLogP0.49
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethoxy-2,5-dihydrofuran?
The IUPAC name of 2,3,5-trimethoxy-2,5-dihydrofuran (CID 12521517) is 2,3,5-trimethoxy-2,5-dihydrofuran.
What is the SMILES notation for 2,3,5-trimethoxy-2,5-dihydrofuran?
The canonical SMILES for 2,3,5-trimethoxy-2,5-dihydrofuran is COC1=CC(OC)OC1OC.
What is the InChIKey of 2,3,5-trimethoxy-2,5-dihydrofuran?
The InChIKey is HZDOLPOBCDTTPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O4/c1-8-5-4-6(9-2)11-7(5)10-3/h4,6-7H,1-3H3.
What are the key properties of 2,3,5-trimethoxy-2,5-dihydrofuran?
2,3,5-trimethoxy-2,5-dihydrofuran has a molecular weight of 160.17 g/mol, XLogP of 0.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethoxy-2,5-dihydrofuran is sourced from PubChem (CID 12521517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).