2-methyloxolane;3-methyloxolane

C10H20O2 — CID 19802292

IUPAC2-methyloxolane;3-methyloxolane
SMILESCC1CCCO1.CC1CCOC1
InChIInChI=1S/2C5H10O/c1-5-2-3-6-4-5;1-5-3-2-4-6-5/h2*5H,2-4H2,1H3
InChIKeyVZJBDBJRZODHRZ-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.23
Rot. Bonds

About 2-methyloxolane;3-methyloxolane

2-methyloxolane;3-methyloxolane (PubChem CID 19802292) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-methyloxolane;3-methyloxolane.

Molecular Properties

Compound Name2-methyloxolane;3-methyloxolane
PubChem CID19802292
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2-methyloxolane;3-methyloxolane
SMILESCC1CCCO1.CC1CCOC1
InChIInChI=1S/2C5H10O/c1-5-2-3-6-4-5;1-5-3-2-4-6-5/h2*5H,2-4H2,1H3
InChIKeyVZJBDBJRZODHRZ-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyloxolane;3-methyloxolane?
The IUPAC name of 2-methyloxolane;3-methyloxolane (CID 19802292) is 2-methyloxolane;3-methyloxolane.
What is the SMILES notation for 2-methyloxolane;3-methyloxolane?
The canonical SMILES for 2-methyloxolane;3-methyloxolane is CC1CCCO1.CC1CCOC1.
What is the InChIKey of 2-methyloxolane;3-methyloxolane?
The InChIKey is VZJBDBJRZODHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H10O/c1-5-2-3-6-4-5;1-5-3-2-4-6-5/h2*5H,2-4H2,1H3.
What are the key properties of 2-methyloxolane;3-methyloxolane?
2-methyloxolane;3-methyloxolane has a molecular weight of 172.27 g/mol, XLogP of 2.23, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyloxolane;3-methyloxolane is sourced from PubChem (CID 19802292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).