2-[(4-methylphenyl)methoxy]oxolane

C12H16O2 — CID 11745476

IUPAC2-[(4-methylphenyl)methoxy]oxolane
SMILESCc1ccc(COC2CCCO2)cc1
InChIInChI=1S/C12H16O2/c1-10-4-6-11(7-5-10)9-14-12-3-2-8-13-12/h4-7,12H,2-3,8-9H2,1H3
InChIKeySUSZBTYLNKEGSB-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.65
Rot. Bonds3

About 2-[(4-methylphenyl)methoxy]oxolane

2-[(4-methylphenyl)methoxy]oxolane (PubChem CID 11745476) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-[(4-methylphenyl)methoxy]oxolane.

Molecular Properties

Compound Name2-[(4-methylphenyl)methoxy]oxolane
PubChem CID11745476
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name2-[(4-methylphenyl)methoxy]oxolane
SMILESCc1ccc(COC2CCCO2)cc1
InChIInChI=1S/C12H16O2/c1-10-4-6-11(7-5-10)9-14-12-3-2-8-13-12/h4-7,12H,2-3,8-9H2,1H3
InChIKeySUSZBTYLNKEGSB-UHFFFAOYSA-N
XLogP2.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenyl)methoxy]oxolane?
The IUPAC name of 2-[(4-methylphenyl)methoxy]oxolane (CID 11745476) is 2-[(4-methylphenyl)methoxy]oxolane.
What is the SMILES notation for 2-[(4-methylphenyl)methoxy]oxolane?
The canonical SMILES for 2-[(4-methylphenyl)methoxy]oxolane is Cc1ccc(COC2CCCO2)cc1.
What is the InChIKey of 2-[(4-methylphenyl)methoxy]oxolane?
The InChIKey is SUSZBTYLNKEGSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-10-4-6-11(7-5-10)9-14-12-3-2-8-13-12/h4-7,12H,2-3,8-9H2,1H3.
What are the key properties of 2-[(4-methylphenyl)methoxy]oxolane?
2-[(4-methylphenyl)methoxy]oxolane has a molecular weight of 192.26 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenyl)methoxy]oxolane is sourced from PubChem (CID 11745476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).