4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane

C12H14O2 — CID 6017272

IUPAC4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane
SMILESCC1COC(/C=C/c2ccccc2)O1
InChIInChI=1S/C12H14O2/c1-10-9-13-12(14-10)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+
InChIKeyMQLAQZSLFAOEAK-BQYQJAHWSA-N
MW190.24 g/mol
LogP2.46
Rot. Bonds2

About 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane

4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane (PubChem CID 6017272) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane.

Molecular Properties

Compound Name4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane
PubChem CID6017272
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane
SMILESCC1COC(/C=C/c2ccccc2)O1
InChIInChI=1S/C12H14O2/c1-10-9-13-12(14-10)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+
InChIKeyMQLAQZSLFAOEAK-BQYQJAHWSA-N
XLogP2.46
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-methyl-2-[(E)-2-phenylethenyl]-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

Related Compounds

(2S,4S)-4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxane
CID 93475595
(2R,4R)-4-(chloromethyl)-2-[(E)-2-phenylethenyl]-1,3-dioxolane
CID 92532420
(2S,4S)-4-(chloromethyl)-2-[(E)-2-phenylethenyl]-1,3-dioxolane
CID 93475636
2-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-dioxolane
CID 44631270
5,5-dimethyl-2-[(E)-2-phenylethenyl]-1,3-dioxane
CID 6043851
(6S,7S,8aS)-6-methoxy-2-[(E)-2-phenylethenyl]-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
CID 176586144
4-[[(2R,4R)-2-[(E)-2-phenylethenyl]-1,3-dioxolan-4-yl]methyl]morpholine
CID 40548294
(3S,3aR,6R,6aR)-3,6-bis(2-phenylethenyl)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 170021549
3-[(E)-2-phenylethenyl]oxetane
CID 132578776
N-[2-[(E)-2-phenylethenyl]-1,3-dioxan-5-yl]benzamide
CID 11312900
(3R,4S,5R)-2-(2-phenylethenyl)oxane-3,4,5-triol
CID 139734184
1,1'-biphenyl;2-methyloxirane
CID 87315109

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane?
The IUPAC name of 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane (CID 6017272) is 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane.
What is the SMILES notation for 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane?
The canonical SMILES for 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane is CC1COC(/C=C/c2ccccc2)O1.
What is the InChIKey of 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane?
The InChIKey is MQLAQZSLFAOEAK-BQYQJAHWSA-N. The full InChI is InChI=1S/C12H14O2/c1-10-9-13-12(14-10)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+.
What are the key properties of 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane?
4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane has a molecular weight of 190.24 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxolane is sourced from PubChem (CID 6017272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).