naphtho[1,2-g][1]benzofuran-11-carbaldehyde

C17H10O2 — CID 14770244

IUPACnaphtho[1,2-g][1]benzofuran-11-carbaldehyde
SMILESO=Cc1cc2c3ccccc3ccc2c2occc12
InChIInChI=1S/C17H10O2/c18-10-12-9-16-13-4-2-1-3-11(13)5-6-15(16)17-14(12)7-8-19-17/h1-10H
InChIKeyRRCPFFXLHWKJNY-UHFFFAOYSA-N
MW246.27 g/mol
LogP4.55
Rot. Bonds1

About naphtho[1,2-g][1]benzofuran-11-carbaldehyde

naphtho[1,2-g][1]benzofuran-11-carbaldehyde (PubChem CID 14770244) has the molecular formula C17H10O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is naphtho[1,2-g][1]benzofuran-11-carbaldehyde.

Molecular Properties

Compound Namenaphtho[1,2-g][1]benzofuran-11-carbaldehyde
PubChem CID14770244
Molecular FormulaC17H10O2
Molecular Weight246.27 g/mol
Exact Mass246.07
IUPAC Namenaphtho[1,2-g][1]benzofuran-11-carbaldehyde
SMILESO=Cc1cc2c3ccccc3ccc2c2occc12
InChIInChI=1S/C17H10O2/c18-10-12-9-16-13-4-2-1-3-11(13)5-6-15(16)17-14(12)7-8-19-17/h1-10H
InChIKeyRRCPFFXLHWKJNY-UHFFFAOYSA-N
XLogP4.55
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

benzo[e][1]benzofuran-4-carbaldehyde
CID 102499967
2-oxobenzo[h]chromene-4-carbaldehyde
CID 11989493
chrysene-1,2,3-tricarbaldehyde
CID 141144423
phenanthrene-2,3-dicarbaldehyde
CID 10466547
benzo[e][1]benzofuran-5-carbaldehyde
CID 150213742
13-oxa-22-azahexacyclo[15.8.0.02,11.03,8.012,16.018,23]pentacosa-1,3,5,7,9,11,14,16,18(23),19,21,24-dodecaene
CID 175465437
1-[9-(2-oxo-2-phenylacetyl)phenanthro[9,10-b]furan-6-yl]-2-phenylethane-1,2-dione
CID 87414104
4-methoxy-7-methyl-1-benzofuran-5-carbaldehyde
CID 82374430
1-methylphenanthrene-3-carbaldehyde
CID 100959540
benzo[g][1,3]benzoxazole-2-carbaldehyde
CID 121009106
benzo[g][1]benzofuran-4-ylboronic acid
CID 171854414
4-chlorobenzo[g][1]benzofuran
CID 176753824

Frequently Asked Questions

What is the IUPAC name of naphtho[1,2-g][1]benzofuran-11-carbaldehyde?
The IUPAC name of naphtho[1,2-g][1]benzofuran-11-carbaldehyde (CID 14770244) is naphtho[1,2-g][1]benzofuran-11-carbaldehyde.
What is the SMILES notation for naphtho[1,2-g][1]benzofuran-11-carbaldehyde?
The canonical SMILES for naphtho[1,2-g][1]benzofuran-11-carbaldehyde is O=Cc1cc2c3ccccc3ccc2c2occc12.
What is the InChIKey of naphtho[1,2-g][1]benzofuran-11-carbaldehyde?
The InChIKey is RRCPFFXLHWKJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10O2/c18-10-12-9-16-13-4-2-1-3-11(13)5-6-15(16)17-14(12)7-8-19-17/h1-10H.
What are the key properties of naphtho[1,2-g][1]benzofuran-11-carbaldehyde?
naphtho[1,2-g][1]benzofuran-11-carbaldehyde has a molecular weight of 246.27 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphtho[1,2-g][1]benzofuran-11-carbaldehyde is sourced from PubChem (CID 14770244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).