7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene

C7H10O — CID 89263315

IUPAC7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene
SMILESCC1CC2=C1OCC2
InChIInChI=1S/C7H10O/c1-5-4-6-2-3-8-7(5)6/h5H,2-4H2,1H3
InChIKeyWNBFKDGAIADQNH-UHFFFAOYSA-N
MW110.16 g/mol
LogP1.70
Rot. Bonds

About 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene

7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene (PubChem CID 89263315) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene.

Molecular Properties

Compound Name7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene
PubChem CID89263315
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Name7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene
SMILESCC1CC2=C1OCC2
InChIInChI=1S/C7H10O/c1-5-4-6-2-3-8-7(5)6/h5H,2-4H2,1H3
InChIKeyWNBFKDGAIADQNH-UHFFFAOYSA-N
XLogP1.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene?
The IUPAC name of 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene (CID 89263315) is 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene.
What is the SMILES notation for 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene?
The canonical SMILES for 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene is CC1CC2=C1OCC2.
What is the InChIKey of 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene?
The InChIKey is WNBFKDGAIADQNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O/c1-5-4-6-2-3-8-7(5)6/h5H,2-4H2,1H3.
What are the key properties of 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene?
7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene has a molecular weight of 110.16 g/mol, XLogP of 1.70, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-oxabicyclo[3.2.0]hept-1(5)-ene is sourced from PubChem (CID 89263315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).