1,8b-dihydroindeno[2,1-b]furan-2-one

C11H8O2 — CID 141047089

IUPAC1,8b-dihydroindeno[2,1-b]furan-2-one
SMILESO=C1CC2C(=Cc3ccccc32)O1
InChIInChI=1S/C11H8O2/c12-11-6-9-8-4-2-1-3-7(8)5-10(9)13-11/h1-5,9H,6H2
InChIKeyBSYVSOCOIWLHMY-UHFFFAOYSA-N
MW172.18 g/mol
LogP2.07
Rot. Bonds

About 1,8b-dihydroindeno[2,1-b]furan-2-one

1,8b-dihydroindeno[2,1-b]furan-2-one (PubChem CID 141047089) has the molecular formula C11H8O2 and a molecular weight of 172.18 g/mol. Its IUPAC name is 1,8b-dihydroindeno[2,1-b]furan-2-one.

Molecular Properties

Compound Name1,8b-dihydroindeno[2,1-b]furan-2-one
PubChem CID141047089
Molecular FormulaC11H8O2
Molecular Weight172.18 g/mol
Exact Mass172.05
IUPAC Name1,8b-dihydroindeno[2,1-b]furan-2-one
SMILESO=C1CC2C(=Cc3ccccc32)O1
InChIInChI=1S/C11H8O2/c12-11-6-9-8-4-2-1-3-7(8)5-10(9)13-11/h1-5,9H,6H2
InChIKeyBSYVSOCOIWLHMY-UHFFFAOYSA-N
XLogP2.07
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,8b-dihydroindeno[2,1-b]furan-2-one?
The IUPAC name of 1,8b-dihydroindeno[2,1-b]furan-2-one (CID 141047089) is 1,8b-dihydroindeno[2,1-b]furan-2-one.
What is the SMILES notation for 1,8b-dihydroindeno[2,1-b]furan-2-one?
The canonical SMILES for 1,8b-dihydroindeno[2,1-b]furan-2-one is O=C1CC2C(=Cc3ccccc32)O1.
What is the InChIKey of 1,8b-dihydroindeno[2,1-b]furan-2-one?
The InChIKey is BSYVSOCOIWLHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8O2/c12-11-6-9-8-4-2-1-3-7(8)5-10(9)13-11/h1-5,9H,6H2.
What are the key properties of 1,8b-dihydroindeno[2,1-b]furan-2-one?
1,8b-dihydroindeno[2,1-b]furan-2-one has a molecular weight of 172.18 g/mol, XLogP of 2.07, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8b-dihydroindeno[2,1-b]furan-2-one is sourced from PubChem (CID 141047089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).