2-(2H-pyran-6-yloxy)-2H-pyran

C10H10O3 — CID 66920444

IUPAC2-(2H-pyran-6-yloxy)-2H-pyran
SMILESC1=CCOC(OC2C=CC=CO2)=C1
InChIInChI=1S/C10H10O3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12-10/h1-7,9H,8H2
InChIKeyKUVGVJJJDDOSAC-UHFFFAOYSA-N
MW178.19 g/mol
LogP1.86
Rot. Bonds2

About 2-(2H-pyran-6-yloxy)-2H-pyran

2-(2H-pyran-6-yloxy)-2H-pyran (PubChem CID 66920444) has the molecular formula C10H10O3 and a molecular weight of 178.19 g/mol. Its IUPAC name is 2-(2H-pyran-6-yloxy)-2H-pyran.

Molecular Properties

Compound Name2-(2H-pyran-6-yloxy)-2H-pyran
PubChem CID66920444
Molecular FormulaC10H10O3
Molecular Weight178.19 g/mol
Exact Mass178.06
IUPAC Name2-(2H-pyran-6-yloxy)-2H-pyran
SMILESC1=CCOC(OC2C=CC=CO2)=C1
InChIInChI=1S/C10H10O3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12-10/h1-7,9H,8H2
InChIKeyKUVGVJJJDDOSAC-UHFFFAOYSA-N
XLogP1.86
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2H-pyran-6-yloxy)-2H-pyran?
The IUPAC name of 2-(2H-pyran-6-yloxy)-2H-pyran (CID 66920444) is 2-(2H-pyran-6-yloxy)-2H-pyran.
What is the SMILES notation for 2-(2H-pyran-6-yloxy)-2H-pyran?
The canonical SMILES for 2-(2H-pyran-6-yloxy)-2H-pyran is C1=CCOC(OC2C=CC=CO2)=C1.
What is the InChIKey of 2-(2H-pyran-6-yloxy)-2H-pyran?
The InChIKey is KUVGVJJJDDOSAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12-10/h1-7,9H,8H2.
What are the key properties of 2-(2H-pyran-6-yloxy)-2H-pyran?
2-(2H-pyran-6-yloxy)-2H-pyran has a molecular weight of 178.19 g/mol, XLogP of 1.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-pyran-6-yloxy)-2H-pyran is sourced from PubChem (CID 66920444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).