2-methyl-2-(2-methylphenyl)-1,3-dioxolane

C11H14O2 — CID 15150473

IUPAC2-methyl-2-(2-methylphenyl)-1,3-dioxolane
SMILESCc1ccccc1C1(C)OCCO1
InChIInChI=1S/C11H14O2/c1-9-5-3-4-6-10(9)11(2)12-7-8-13-11/h3-6H,7-8H2,1-2H3
InChIKeyWFENFESLVYPJAF-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.21
Rot. Bonds1

About 2-methyl-2-(2-methylphenyl)-1,3-dioxolane

2-methyl-2-(2-methylphenyl)-1,3-dioxolane (PubChem CID 15150473) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-methyl-2-(2-methylphenyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-methyl-2-(2-methylphenyl)-1,3-dioxolane
PubChem CID15150473
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name2-methyl-2-(2-methylphenyl)-1,3-dioxolane
SMILESCc1ccccc1C1(C)OCCO1
InChIInChI=1S/C11H14O2/c1-9-5-3-4-6-10(9)11(2)12-7-8-13-11/h3-6H,7-8H2,1-2H3
InChIKeyWFENFESLVYPJAF-UHFFFAOYSA-N
XLogP2.21
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 62375
O-Methylbenzyl acetate
CID 87085
Benzaldehyde propylene glycol acetal
CID 595928
(Diethoxymethyl)benzene
CID 69884
1-Benzyloxy-1-(2-methoxyethoxy)ethane
CID 22235151
1,3-Dihydroisobenzofuran
CID 10327
2,5,5-Trimethyl-2-phenyl-1,3-dioxane
CID 79409
1,3-Dioxolane-4-methanol, 2-phenyl-
CID 15572
4-Methyl-4-phenyl-1,3-dioxane
CID 92875
1,3-Dioxolane, 2-methyl-4-phenyl-
CID 118119
4-Methylbenzaldehyde propyleneglycol acetal
CID 94001
Benzene, (1-ethoxyethyl)-
CID 18693

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-methylphenyl)-1,3-dioxolane?
The IUPAC name of 2-methyl-2-(2-methylphenyl)-1,3-dioxolane (CID 15150473) is 2-methyl-2-(2-methylphenyl)-1,3-dioxolane.
What is the SMILES notation for 2-methyl-2-(2-methylphenyl)-1,3-dioxolane?
The canonical SMILES for 2-methyl-2-(2-methylphenyl)-1,3-dioxolane is Cc1ccccc1C1(C)OCCO1.
What is the InChIKey of 2-methyl-2-(2-methylphenyl)-1,3-dioxolane?
The InChIKey is WFENFESLVYPJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-9-5-3-4-6-10(9)11(2)12-7-8-13-11/h3-6H,7-8H2,1-2H3.
What are the key properties of 2-methyl-2-(2-methylphenyl)-1,3-dioxolane?
2-methyl-2-(2-methylphenyl)-1,3-dioxolane has a molecular weight of 178.23 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-methylphenyl)-1,3-dioxolane is sourced from PubChem (CID 15150473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).