2,3,4,7-tetramethoxydibenzofuran-1,6-diol

C16H16O7 — CID 171115286

IUPAC2,3,4,7-tetramethoxydibenzofuran-1,6-diol
SMILESCOc1ccc2c(oc3c(OC)c(OC)c(OC)c(O)c32)c1O
InChIInChI=1S/C16H16O7/c1-19-8-6-5-7-9-11(18)14(20-2)16(22-4)15(21-3)13(9)23-12(7)10(8)17/h5-6,17-18H,1-4H3
InChIKeyQGXIFXRLCUABHP-UHFFFAOYSA-N
MW320.30 g/mol
LogP3.03
Rot. Bonds4

About 2,3,4,7-tetramethoxydibenzofuran-1,6-diol

2,3,4,7-tetramethoxydibenzofuran-1,6-diol (PubChem CID 171115286) has the molecular formula C16H16O7 and a molecular weight of 320.30 g/mol. Its IUPAC name is 2,3,4,7-tetramethoxydibenzofuran-1,6-diol.

Molecular Properties

Compound Name2,3,4,7-tetramethoxydibenzofuran-1,6-diol
PubChem CID171115286
Molecular FormulaC16H16O7
Molecular Weight320.30 g/mol
Exact Mass320.09
IUPAC Name2,3,4,7-tetramethoxydibenzofuran-1,6-diol
SMILESCOc1ccc2c(oc3c(OC)c(OC)c(OC)c(O)c32)c1O
InChIInChI=1S/C16H16O7/c1-19-8-6-5-7-9-11(18)14(20-2)16(22-4)15(21-3)13(9)23-12(7)10(8)17/h5-6,17-18H,1-4H3
InChIKeyQGXIFXRLCUABHP-UHFFFAOYSA-N
XLogP3.03
TPSA90.52 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.30
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,7-tetramethoxydibenzofuran-1,6-diol?
The IUPAC name of 2,3,4,7-tetramethoxydibenzofuran-1,6-diol (CID 171115286) is 2,3,4,7-tetramethoxydibenzofuran-1,6-diol.
What is the SMILES notation for 2,3,4,7-tetramethoxydibenzofuran-1,6-diol?
The canonical SMILES for 2,3,4,7-tetramethoxydibenzofuran-1,6-diol is COc1ccc2c(oc3c(OC)c(OC)c(OC)c(O)c32)c1O.
What is the InChIKey of 2,3,4,7-tetramethoxydibenzofuran-1,6-diol?
The InChIKey is QGXIFXRLCUABHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O7/c1-19-8-6-5-7-9-11(18)14(20-2)16(22-4)15(21-3)13(9)23-12(7)10(8)17/h5-6,17-18H,1-4H3.
What are the key properties of 2,3,4,7-tetramethoxydibenzofuran-1,6-diol?
2,3,4,7-tetramethoxydibenzofuran-1,6-diol has a molecular weight of 320.30 g/mol, XLogP of 3.03, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,7-tetramethoxydibenzofuran-1,6-diol is sourced from PubChem (CID 171115286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).