2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane

C11H14O3 — CID 601628

IUPAC2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane
SMILESCOc1ccc(C2(C)OCCO2)cc1
InChIInChI=1S/C11H14O3/c1-11(13-7-8-14-11)9-3-5-10(12-2)6-4-9/h3-6H,7-8H2,1-2H3
InChIKeyMTCMJWNLFRJTTN-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.91
Rot. Bonds2

About 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane

2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane (PubChem CID 601628) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane
PubChem CID601628
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane
SMILESCOc1ccc(C2(C)OCCO2)cc1
InChIInChI=1S/C11H14O3/c1-11(13-7-8-14-11)9-3-5-10(12-2)6-4-9/h3-6H,7-8H2,1-2H3
InChIKeyMTCMJWNLFRJTTN-UHFFFAOYSA-N
XLogP1.91
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane?
The IUPAC name of 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane (CID 601628) is 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane.
What is the SMILES notation for 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane?
The canonical SMILES for 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane is COc1ccc(C2(C)OCCO2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane?
The InChIKey is MTCMJWNLFRJTTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-11(13-7-8-14-11)9-3-5-10(12-2)6-4-9/h3-6H,7-8H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane?
2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane has a molecular weight of 194.23 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2-methyl-1,3-dioxolane is sourced from PubChem (CID 601628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).