1-methoxycyclobutene

C5H8O — CID 14546685

IUPAC1-methoxycyclobutene
SMILESCOC1=CCC1
InChIInChI=1S/C5H8O/c1-6-5-3-2-4-5/h3H,2,4H2,1H3
InChIKeyQUOWJBWZSDXDJA-UHFFFAOYSA-N
MW84.12 g/mol
LogP1.31
Rot. Bonds1

About 1-methoxycyclobutene

1-methoxycyclobutene (PubChem CID 14546685) has the molecular formula C5H8O and a molecular weight of 84.12 g/mol. Its IUPAC name is 1-methoxycyclobutene.

Molecular Properties

Compound Name1-methoxycyclobutene
PubChem CID14546685
Molecular FormulaC5H8O
Molecular Weight84.12 g/mol
Exact Mass84.06
IUPAC Name1-methoxycyclobutene
SMILESCOC1=CCC1
InChIInChI=1S/C5H8O/c1-6-5-3-2-4-5/h3H,2,4H2,1H3
InChIKeyQUOWJBWZSDXDJA-UHFFFAOYSA-N
XLogP1.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.12
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methoxycyclobutene?
The IUPAC name of 1-methoxycyclobutene (CID 14546685) is 1-methoxycyclobutene.
What is the SMILES notation for 1-methoxycyclobutene?
The canonical SMILES for 1-methoxycyclobutene is COC1=CCC1.
What is the InChIKey of 1-methoxycyclobutene?
The InChIKey is QUOWJBWZSDXDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O/c1-6-5-3-2-4-5/h3H,2,4H2,1H3.
What are the key properties of 1-methoxycyclobutene?
1-methoxycyclobutene has a molecular weight of 84.12 g/mol, XLogP of 1.31, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxycyclobutene is sourced from PubChem (CID 14546685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).