furo[2,3-g][1,3]benzodioxole-5-carbaldehyde

C10H6O4 — CID 82374428

IUPACfuro[2,3-g][1,3]benzodioxole-5-carbaldehyde
SMILESO=Cc1cc2c(c3ccoc13)OCO2
InChIInChI=1S/C10H6O4/c11-4-6-3-8-10(14-5-13-8)7-1-2-12-9(6)7/h1-4H,5H2
InChIKeyAGSPUQIIZDQPSH-UHFFFAOYSA-N
MW190.15 g/mol
LogP1.97
Rot. Bonds1

About furo[2,3-g][1,3]benzodioxole-5-carbaldehyde

furo[2,3-g][1,3]benzodioxole-5-carbaldehyde (PubChem CID 82374428) has the molecular formula C10H6O4 and a molecular weight of 190.15 g/mol. Its IUPAC name is furo[2,3-g][1,3]benzodioxole-5-carbaldehyde.

Molecular Properties

Compound Namefuro[2,3-g][1,3]benzodioxole-5-carbaldehyde
PubChem CID82374428
Molecular FormulaC10H6O4
Molecular Weight190.15 g/mol
Exact Mass190.03
IUPAC Namefuro[2,3-g][1,3]benzodioxole-5-carbaldehyde
SMILESO=Cc1cc2c(c3ccoc13)OCO2
InChIInChI=1S/C10H6O4/c11-4-6-3-8-10(14-5-13-8)7-1-2-12-9(6)7/h1-4H,5H2
InChIKeyAGSPUQIIZDQPSH-UHFFFAOYSA-N
XLogP1.97
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.15
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze furo[2,3-g][1,3]benzodioxole-5-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzo[g][1,3]benzodioxole-5-carbaldehyde
CID 12524007
benzo[e][1]benzofuran-4-carbaldehyde
CID 102499967
6-methyl-1,3-benzodioxole-4-carbaldehyde
CID 58304897
6-fluoro-1,3-benzodioxole-5-carbaldehyde
CID 14384443
6-ethenyl-1,3-benzodioxole-5-carbaldehyde
CID 11159619
N-(6-formyl-5-methoxy-1,3-benzodioxol-4-yl)acetamide
CID 84798418
naphtho[1,2-g][1]benzofuran-11-carbaldehyde
CID 14770244
5-methylbenzo[g][1,3]benzodioxole
CID 90367464
N-(7-formyl-1,3-benzodioxol-5-yl)acetamide
CID 84779325
7-methoxy-6-[4-methoxy-6-[tri(propan-2-yl)silyloxymethyl]-1,3-benzodioxol-5-yl]-1,3-benzodioxole-5-carbaldehyde
CID 25034229
5-acetyl-1-benzofuran-7-carbaldehyde
CID 21220947
4,5-dimethoxy-6-prop-1-enyl-1,3-benzodioxole
CID 53397162

Frequently Asked Questions

What is the IUPAC name of furo[2,3-g][1,3]benzodioxole-5-carbaldehyde?
The IUPAC name of furo[2,3-g][1,3]benzodioxole-5-carbaldehyde (CID 82374428) is furo[2,3-g][1,3]benzodioxole-5-carbaldehyde.
What is the SMILES notation for furo[2,3-g][1,3]benzodioxole-5-carbaldehyde?
The canonical SMILES for furo[2,3-g][1,3]benzodioxole-5-carbaldehyde is O=Cc1cc2c(c3ccoc13)OCO2.
What is the InChIKey of furo[2,3-g][1,3]benzodioxole-5-carbaldehyde?
The InChIKey is AGSPUQIIZDQPSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6O4/c11-4-6-3-8-10(14-5-13-8)7-1-2-12-9(6)7/h1-4H,5H2.
What are the key properties of furo[2,3-g][1,3]benzodioxole-5-carbaldehyde?
furo[2,3-g][1,3]benzodioxole-5-carbaldehyde has a molecular weight of 190.15 g/mol, XLogP of 1.97, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furo[2,3-g][1,3]benzodioxole-5-carbaldehyde is sourced from PubChem (CID 82374428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).