(5-methylfuran-2-yl)methanol

C6H8O2 — CID 520911

IUPAC(5-methylfuran-2-yl)methanol
SMILESCc1ccc(CO)o1
InChIInChI=1S/C6H8O2/c1-5-2-3-6(4-7)8-5/h2-3,7H,4H2,1H3
InChIKeyVOZFDEJGHQWZHU-UHFFFAOYSA-N
MW112.13 g/mol
LogP1.08
Rot. Bonds1

About (5-methylfuran-2-yl)methanol

(5-methylfuran-2-yl)methanol (PubChem CID 520911) has the molecular formula C6H8O2 and a molecular weight of 112.13 g/mol. Its IUPAC name is (5-methylfuran-2-yl)methanol.

Molecular Properties

Compound Name(5-methylfuran-2-yl)methanol
PubChem CID520911
Molecular FormulaC6H8O2
Molecular Weight112.13 g/mol
Exact Mass112.05
IUPAC Name(5-methylfuran-2-yl)methanol
SMILESCc1ccc(CO)o1
InChIInChI=1S/C6H8O2/c1-5-2-3-6(4-7)8-5/h2-3,7H,4H2,1H3
InChIKeyVOZFDEJGHQWZHU-UHFFFAOYSA-N
XLogP1.08
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.13
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-methylfuran-2-yl)methanol?
The IUPAC name of (5-methylfuran-2-yl)methanol (CID 520911) is (5-methylfuran-2-yl)methanol.
What is the SMILES notation for (5-methylfuran-2-yl)methanol?
The canonical SMILES for (5-methylfuran-2-yl)methanol is Cc1ccc(CO)o1.
What is the InChIKey of (5-methylfuran-2-yl)methanol?
The InChIKey is VOZFDEJGHQWZHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O2/c1-5-2-3-6(4-7)8-5/h2-3,7H,4H2,1H3.
What are the key properties of (5-methylfuran-2-yl)methanol?
(5-methylfuran-2-yl)methanol has a molecular weight of 112.13 g/mol, XLogP of 1.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylfuran-2-yl)methanol is sourced from PubChem (CID 520911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).