3-methyl-5-methylidene-2H-furan-2-ol

C6H8O2 — CID 123646544

IUPAC3-methyl-5-methylidene-2H-furan-2-ol
SMILESC=C1C=C(C)C(O)O1
InChIInChI=1S/C6H8O2/c1-4-3-5(2)8-6(4)7/h3,6-7H,2H2,1H3
InChIKeyQEXLRLXZHYXYJO-UHFFFAOYSA-N
MW112.13 g/mol
LogP0.80
Rot. Bonds

About 3-methyl-5-methylidene-2H-furan-2-ol

3-methyl-5-methylidene-2H-furan-2-ol (PubChem CID 123646544) has the molecular formula C6H8O2 and a molecular weight of 112.13 g/mol. Its IUPAC name is 3-methyl-5-methylidene-2H-furan-2-ol.

Molecular Properties

Compound Name3-methyl-5-methylidene-2H-furan-2-ol
PubChem CID123646544
Molecular FormulaC6H8O2
Molecular Weight112.13 g/mol
Exact Mass112.05
IUPAC Name3-methyl-5-methylidene-2H-furan-2-ol
SMILESC=C1C=C(C)C(O)O1
InChIInChI=1S/C6H8O2/c1-4-3-5(2)8-6(4)7/h3,6-7H,2H2,1H3
InChIKeyQEXLRLXZHYXYJO-UHFFFAOYSA-N
XLogP0.80
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.13
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-methylidene-2H-furan-2-ol?
The IUPAC name of 3-methyl-5-methylidene-2H-furan-2-ol (CID 123646544) is 3-methyl-5-methylidene-2H-furan-2-ol.
What is the SMILES notation for 3-methyl-5-methylidene-2H-furan-2-ol?
The canonical SMILES for 3-methyl-5-methylidene-2H-furan-2-ol is C=C1C=C(C)C(O)O1.
What is the InChIKey of 3-methyl-5-methylidene-2H-furan-2-ol?
The InChIKey is QEXLRLXZHYXYJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O2/c1-4-3-5(2)8-6(4)7/h3,6-7H,2H2,1H3.
What are the key properties of 3-methyl-5-methylidene-2H-furan-2-ol?
3-methyl-5-methylidene-2H-furan-2-ol has a molecular weight of 112.13 g/mol, XLogP of 0.80, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-methylidene-2H-furan-2-ol is sourced from PubChem (CID 123646544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).