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

C12H16O2 — CID 11830267

IUPAC2-methyl-2-(2-phenylethyl)-1,3-dioxolane
SMILESCC1(CCc2ccccc2)OCCO1
InChIInChI=1S/C12H16O2/c1-12(13-9-10-14-12)8-7-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKeyOJOLQQYGVSXYOP-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.38
Rot. Bonds3

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

2-methyl-2-(2-phenylethyl)-1,3-dioxolane (PubChem CID 11830267) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-methyl-2-(2-phenylethyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-methyl-2-(2-phenylethyl)-1,3-dioxolane
PubChem CID11830267
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name2-methyl-2-(2-phenylethyl)-1,3-dioxolane
SMILESCC1(CCc2ccccc2)OCCO1
InChIInChI=1S/C12H16O2/c1-12(13-9-10-14-12)8-7-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKeyOJOLQQYGVSXYOP-UHFFFAOYSA-N
XLogP2.38
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 ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-phenylethyl)-1,3-dioxolane?
The IUPAC name of 2-methyl-2-(2-phenylethyl)-1,3-dioxolane (CID 11830267) is 2-methyl-2-(2-phenylethyl)-1,3-dioxolane.
What is the SMILES notation for 2-methyl-2-(2-phenylethyl)-1,3-dioxolane?
The canonical SMILES for 2-methyl-2-(2-phenylethyl)-1,3-dioxolane is CC1(CCc2ccccc2)OCCO1.
What is the InChIKey of 2-methyl-2-(2-phenylethyl)-1,3-dioxolane?
The InChIKey is OJOLQQYGVSXYOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-12(13-9-10-14-12)8-7-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3.
What are the key properties of 2-methyl-2-(2-phenylethyl)-1,3-dioxolane?
2-methyl-2-(2-phenylethyl)-1,3-dioxolane has a molecular weight of 192.26 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-phenylethyl)-1,3-dioxolane is sourced from PubChem (CID 11830267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).