2,5-bis(propan-2-yloxymethyl)furan

C12H20O3 — CID 102358126

IUPAC2,5-bis(propan-2-yloxymethyl)furan
SMILESCC(C)OCc1ccc(COC(C)C)o1
InChIInChI=1S/C12H20O3/c1-9(2)13-7-11-5-6-12(15-11)8-14-10(3)4/h5-6,9-10H,7-8H2,1-4H3
InChIKeyOBIAZIMIEKWXDC-UHFFFAOYSA-N
MW212.29 g/mol
LogP3.13
Rot. Bonds6

About 2,5-bis(propan-2-yloxymethyl)furan

2,5-bis(propan-2-yloxymethyl)furan (PubChem CID 102358126) has the molecular formula C12H20O3 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2,5-bis(propan-2-yloxymethyl)furan.

Molecular Properties

Compound Name2,5-bis(propan-2-yloxymethyl)furan
PubChem CID102358126
Molecular FormulaC12H20O3
Molecular Weight212.29 g/mol
Exact Mass212.14
IUPAC Name2,5-bis(propan-2-yloxymethyl)furan
SMILESCC(C)OCc1ccc(COC(C)C)o1
InChIInChI=1S/C12H20O3/c1-9(2)13-7-11-5-6-12(15-11)8-14-10(3)4/h5-6,9-10H,7-8H2,1-4H3
InChIKeyOBIAZIMIEKWXDC-UHFFFAOYSA-N
XLogP3.13
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(propan-2-yloxymethyl)furan?
The IUPAC name of 2,5-bis(propan-2-yloxymethyl)furan (CID 102358126) is 2,5-bis(propan-2-yloxymethyl)furan.
What is the SMILES notation for 2,5-bis(propan-2-yloxymethyl)furan?
The canonical SMILES for 2,5-bis(propan-2-yloxymethyl)furan is CC(C)OCc1ccc(COC(C)C)o1.
What is the InChIKey of 2,5-bis(propan-2-yloxymethyl)furan?
The InChIKey is OBIAZIMIEKWXDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O3/c1-9(2)13-7-11-5-6-12(15-11)8-14-10(3)4/h5-6,9-10H,7-8H2,1-4H3.
What are the key properties of 2,5-bis(propan-2-yloxymethyl)furan?
2,5-bis(propan-2-yloxymethyl)furan has a molecular weight of 212.29 g/mol, XLogP of 3.13, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(propan-2-yloxymethyl)furan is sourced from PubChem (CID 102358126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).