2-[(4-chlorophenyl)methoxy]oxolane

C11H13ClO2 — CID 102105550

IUPAC2-[(4-chlorophenyl)methoxy]oxolane
SMILESClc1ccc(COC2CCCO2)cc1
InChIInChI=1S/C11H13ClO2/c12-10-5-3-9(4-6-10)8-14-11-2-1-7-13-11/h3-6,11H,1-2,7-8H2
InChIKeyJZIKDDQYZOVWLJ-UHFFFAOYSA-N
MW212.68 g/mol
LogP2.99
Rot. Bonds3

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

2-[(4-chlorophenyl)methoxy]oxolane (PubChem CID 102105550) has the molecular formula C11H13ClO2 and a molecular weight of 212.68 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methoxy]oxolane.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methoxy]oxolane
PubChem CID102105550
Molecular FormulaC11H13ClO2
Molecular Weight212.68 g/mol
Exact Mass212.06
IUPAC Name2-[(4-chlorophenyl)methoxy]oxolane
SMILESClc1ccc(COC2CCCO2)cc1
InChIInChI=1S/C11H13ClO2/c12-10-5-3-9(4-6-10)8-14-11-2-1-7-13-11/h3-6,11H,1-2,7-8H2
InChIKeyJZIKDDQYZOVWLJ-UHFFFAOYSA-N
XLogP2.99
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methoxy]oxolane?
The IUPAC name of 2-[(4-chlorophenyl)methoxy]oxolane (CID 102105550) is 2-[(4-chlorophenyl)methoxy]oxolane.
What is the SMILES notation for 2-[(4-chlorophenyl)methoxy]oxolane?
The canonical SMILES for 2-[(4-chlorophenyl)methoxy]oxolane is Clc1ccc(COC2CCCO2)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)methoxy]oxolane?
The InChIKey is JZIKDDQYZOVWLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClO2/c12-10-5-3-9(4-6-10)8-14-11-2-1-7-13-11/h3-6,11H,1-2,7-8H2.
What are the key properties of 2-[(4-chlorophenyl)methoxy]oxolane?
2-[(4-chlorophenyl)methoxy]oxolane has a molecular weight of 212.68 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methoxy]oxolane is sourced from PubChem (CID 102105550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).