[2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol

C18H16O3 — CID 11334991

IUPAC[2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol
SMILESOCc1ccccc1-c1ccc(-c2ccccc2CO)o1
InChIInChI=1S/C18H16O3/c19-11-13-5-1-3-7-15(13)17-9-10-18(21-17)16-8-4-2-6-14(16)12-20/h1-10,19-20H,11-12H2
InChIKeyVSSSLMHWAUMZPL-UHFFFAOYSA-N
MW280.32 g/mol
LogP3.60
Rot. Bonds4

About [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol

[2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol (PubChem CID 11334991) has the molecular formula C18H16O3 and a molecular weight of 280.32 g/mol. Its IUPAC name is [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol.

Molecular Properties

Compound Name[2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol
PubChem CID11334991
Molecular FormulaC18H16O3
Molecular Weight280.32 g/mol
Exact Mass280.11
IUPAC Name[2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol
SMILESOCc1ccccc1-c1ccc(-c2ccccc2CO)o1
InChIInChI=1S/C18H16O3/c19-11-13-5-1-3-7-15(13)17-9-10-18(21-17)16-8-4-2-6-14(16)12-20/h1-10,19-20H,11-12H2
InChIKeyVSSSLMHWAUMZPL-UHFFFAOYSA-N
XLogP3.60
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol?
The IUPAC name of [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol (CID 11334991) is [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol.
What is the SMILES notation for [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol?
The canonical SMILES for [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol is OCc1ccccc1-c1ccc(-c2ccccc2CO)o1.
What is the InChIKey of [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol?
The InChIKey is VSSSLMHWAUMZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O3/c19-11-13-5-1-3-7-15(13)17-9-10-18(21-17)16-8-4-2-6-14(16)12-20/h1-10,19-20H,11-12H2.
What are the key properties of [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol?
[2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol has a molecular weight of 280.32 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol is sourced from PubChem (CID 11334991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).