4-methyl-2-phenyl-1,3-dioxolane

C10H12O2 — CID 595928

IUPAC4-methyl-2-phenyl-1,3-dioxolane
SMILESCC1COC(c2ccccc2)O1
InChIInChI=1S/C10H12O2/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3
InChIKeyCDIKGISJRLTLRA-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.12
Rot. Bonds1

About 4-methyl-2-phenyl-1,3-dioxolane

4-methyl-2-phenyl-1,3-dioxolane (PubChem CID 595928) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 4-methyl-2-phenyl-1,3-dioxolane.

Molecular Properties

Compound Name4-methyl-2-phenyl-1,3-dioxolane
PubChem CID595928
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name4-methyl-2-phenyl-1,3-dioxolane
SMILESCC1COC(c2ccccc2)O1
InChIInChI=1S/C10H12O2/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3
InChIKeyCDIKGISJRLTLRA-UHFFFAOYSA-N
XLogP2.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-phenyl-1,3-dioxolane?
The IUPAC name of 4-methyl-2-phenyl-1,3-dioxolane (CID 595928) is 4-methyl-2-phenyl-1,3-dioxolane.
What is the SMILES notation for 4-methyl-2-phenyl-1,3-dioxolane?
The canonical SMILES for 4-methyl-2-phenyl-1,3-dioxolane is CC1COC(c2ccccc2)O1.
What is the InChIKey of 4-methyl-2-phenyl-1,3-dioxolane?
The InChIKey is CDIKGISJRLTLRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3.
What are the key properties of 4-methyl-2-phenyl-1,3-dioxolane?
4-methyl-2-phenyl-1,3-dioxolane has a molecular weight of 164.20 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-phenyl-1,3-dioxolane is sourced from PubChem (CID 595928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).