2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran

C17H20O — CID 118470452

IUPAC2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran
SMILESCC1=C2C(C)=C(C)OC2C2=C(C)C(C)=C(C)C2=C1
InChIInChI=1S/C17H20O/c1-8-7-14-10(3)9(2)11(4)16(14)17-15(8)12(5)13(6)18-17/h7,17H,1-6H3
InChIKeyAMJLGIHYWJDCFB-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.60
Rot. Bonds

About 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran

2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran (PubChem CID 118470452) has the molecular formula C17H20O and a molecular weight of 240.35 g/mol. Its IUPAC name is 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran.

Molecular Properties

Compound Name2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran
PubChem CID118470452
Molecular FormulaC17H20O
Molecular Weight240.35 g/mol
Exact Mass240.15
IUPAC Name2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran
SMILESCC1=C2C(C)=C(C)OC2C2=C(C)C(C)=C(C)C2=C1
InChIInChI=1S/C17H20O/c1-8-7-14-10(3)9(2)11(4)16(14)17-15(8)12(5)13(6)18-17/h7,17H,1-6H3
InChIKeyAMJLGIHYWJDCFB-UHFFFAOYSA-N
XLogP4.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran?
The IUPAC name of 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran (CID 118470452) is 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran.
What is the SMILES notation for 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran?
The canonical SMILES for 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran is CC1=C2C(C)=C(C)OC2C2=C(C)C(C)=C(C)C2=C1.
What is the InChIKey of 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran?
The InChIKey is AMJLGIHYWJDCFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O/c1-8-7-14-10(3)9(2)11(4)16(14)17-15(8)12(5)13(6)18-17/h7,17H,1-6H3.
What are the key properties of 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran?
2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran has a molecular weight of 240.35 g/mol, XLogP of 4.60, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,6,7,8-hexamethyl-8bH-cyclopenta[g][1]benzofuran is sourced from PubChem (CID 118470452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).