8H-cyclopenta[f][1,3]benzodioxole

C10H8O2 — CID 142694134

IUPAC8H-cyclopenta[f][1,3]benzodioxole
SMILESC1=CC2=CC3=C(CC2=C1)OCO3
InChIInChI=1S/C10H8O2/c1-2-7-4-9-10(12-6-11-9)5-8(7)3-1/h1-4H,5-6H2
InChIKeyWHNROZLXUSRLTL-UHFFFAOYSA-N
MW160.17 g/mol
LogP2.03
Rot. Bonds

About 8H-cyclopenta[f][1,3]benzodioxole

8H-cyclopenta[f][1,3]benzodioxole (PubChem CID 142694134) has the molecular formula C10H8O2 and a molecular weight of 160.17 g/mol. Its IUPAC name is 8H-cyclopenta[f][1,3]benzodioxole.

Molecular Properties

Compound Name8H-cyclopenta[f][1,3]benzodioxole
PubChem CID142694134
Molecular FormulaC10H8O2
Molecular Weight160.17 g/mol
Exact Mass160.05
IUPAC Name8H-cyclopenta[f][1,3]benzodioxole
SMILESC1=CC2=CC3=C(CC2=C1)OCO3
InChIInChI=1S/C10H8O2/c1-2-7-4-9-10(12-6-11-9)5-8(7)3-1/h1-4H,5-6H2
InChIKeyWHNROZLXUSRLTL-UHFFFAOYSA-N
XLogP2.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methoxy-5-prop-2-enyl-4H-1,3-benzodioxole
CID 129636699
5-Prop-2-enyl-3a,4-dihydro-1,3-benzodioxole
CID 67302335
Methylene 3,4-methylenedioxybenzene
CID 162393126
4H-cyclopenta[g][1,3]benzodioxol-2-ol
CID 17981054
2,2'-spirobi[4H-1-benzofuran]
CID 19853412
8,10-dihydro-7H-cyclohepta[f][1,3]benzodioxole
CID 20066638
4,5-Dihydro-1,3-benzodioxole
CID 21862855
4H-cyclopenta[g][1,3]benzodioxole
CID 21933619
8H-indeno[1,2-d][1,3]dioxole
CID 23131912
5-Prop-2-enyl-4,5-dihydro-1,3-benzodioxole
CID 54036155
6-chloro-5H-indeno[1,2-d][1,3]dioxole
CID 57152058
5-propan-2-ylidene-4H-1,3-benzodioxole
CID 57317605

Frequently Asked Questions

What is the IUPAC name of 8H-cyclopenta[f][1,3]benzodioxole?
The IUPAC name of 8H-cyclopenta[f][1,3]benzodioxole (CID 142694134) is 8H-cyclopenta[f][1,3]benzodioxole.
What is the SMILES notation for 8H-cyclopenta[f][1,3]benzodioxole?
The canonical SMILES for 8H-cyclopenta[f][1,3]benzodioxole is C1=CC2=CC3=C(CC2=C1)OCO3.
What is the InChIKey of 8H-cyclopenta[f][1,3]benzodioxole?
The InChIKey is WHNROZLXUSRLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O2/c1-2-7-4-9-10(12-6-11-9)5-8(7)3-1/h1-4H,5-6H2.
What are the key properties of 8H-cyclopenta[f][1,3]benzodioxole?
8H-cyclopenta[f][1,3]benzodioxole has a molecular weight of 160.17 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8H-cyclopenta[f][1,3]benzodioxole is sourced from PubChem (CID 142694134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).