(2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane

C11H13ClO2 — CID 71697570

IUPAC(2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane
SMILESCO[C@H]1C[C@H](c2ccc(Cl)cc2)CO1
InChIInChI=1S/C11H13ClO2/c1-13-11-6-9(7-14-11)8-2-4-10(12)5-3-8/h2-5,9,11H,6-7H2,1H3/t9-,11+/m0/s1
InChIKeyKOQBZUFDHPAUQA-GXSJLCMTSA-N
MW212.68 g/mol
LogP2.82
Rot. Bonds2

About (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane

(2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane (PubChem CID 71697570) has the molecular formula C11H13ClO2 and a molecular weight of 212.68 g/mol. Its IUPAC name is (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane.

Molecular Properties

Compound Name(2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane
PubChem CID71697570
Molecular FormulaC11H13ClO2
Molecular Weight212.68 g/mol
Exact Mass212.06
IUPAC Name(2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane
SMILESCO[C@H]1C[C@H](c2ccc(Cl)cc2)CO1
InChIInChI=1S/C11H13ClO2/c1-13-11-6-9(7-14-11)8-2-4-10(12)5-3-8/h2-5,9,11H,6-7H2,1H3/t9-,11+/m0/s1
InChIKeyKOQBZUFDHPAUQA-GXSJLCMTSA-N
XLogP2.82
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane?
The IUPAC name of (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane (CID 71697570) is (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane.
What is the SMILES notation for (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane?
The canonical SMILES for (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane is CO[C@H]1C[C@H](c2ccc(Cl)cc2)CO1.
What is the InChIKey of (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane?
The InChIKey is KOQBZUFDHPAUQA-GXSJLCMTSA-N. The full InChI is InChI=1S/C11H13ClO2/c1-13-11-6-9(7-14-11)8-2-4-10(12)5-3-8/h2-5,9,11H,6-7H2,1H3/t9-,11+/m0/s1.
What are the key properties of (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane?
(2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane has a molecular weight of 212.68 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-4-(4-chlorophenyl)-2-methoxyoxolane is sourced from PubChem (CID 71697570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).