[5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol

C14H12O3 — CID 155432264

IUPAC[5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol
SMILESOCc1ccc(/C=C2/Cc3ccccc3O2)o1
InChIInChI=1S/C14H12O3/c15-9-12-6-5-11(16-12)8-13-7-10-3-1-2-4-14(10)17-13/h1-6,8,15H,7,9H2/b13-8-
InChIKeyCJVITPLFXKETOD-JYRVWZFOSA-N
MW228.25 g/mol
LogP2.75
Rot. Bonds2

About [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol

[5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol (PubChem CID 155432264) has the molecular formula C14H12O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol
PubChem CID155432264
Molecular FormulaC14H12O3
Molecular Weight228.25 g/mol
Exact Mass228.08
IUPAC Name[5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol
SMILESOCc1ccc(/C=C2/Cc3ccccc3O2)o1
InChIInChI=1S/C14H12O3/c15-9-12-6-5-11(16-12)8-13-7-10-3-1-2-4-14(10)17-13/h1-6,8,15H,7,9H2/b13-8-
InChIKeyCJVITPLFXKETOD-JYRVWZFOSA-N
XLogP2.75
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol?
The IUPAC name of [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol (CID 155432264) is [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol?
The canonical SMILES for [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol is OCc1ccc(/C=C2/Cc3ccccc3O2)o1.
What is the InChIKey of [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol?
The InChIKey is CJVITPLFXKETOD-JYRVWZFOSA-N. The full InChI is InChI=1S/C14H12O3/c15-9-12-6-5-11(16-12)8-13-7-10-3-1-2-4-14(10)17-13/h1-6,8,15H,7,9H2/b13-8-.
What are the key properties of [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol?
[5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol has a molecular weight of 228.25 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(Z)-3H-1-benzofuran-2-ylidenemethyl]furan-2-yl]methanol is sourced from PubChem (CID 155432264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).