chempirical

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

C10H12O2CAS 2568-25-4164.20 g/mol

Open in Covalent MOL file
OO
AcetalEther

Properties

Molecular formula
C10H12O2
Molar mass
164.20 g/mol
Exact mass
164.0837 Da
Boiling point
118 °C
logP
2.12Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
2568-25-4
SMILES
CC1COC(c2ccccc2)O1
InChIKey
CDIKGISJRLTLRA-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O2/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • 1,3-Dioxolane, 4-methyl-2-phenyl-
  • Benzaldehyde propylene glycol acetal
  • 2-Phenyl-4-methyl-1,3-dioxolane

Work with 4-Methyl-2-phenyl-1,3-dioxolane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3:4,6-Di-O-benzylidene-D-mannitol28224-73-955 % similar (Diethoxymethyl)benzene774-48-150 % similar Vanillin propylene glycol acetal68527-74-248 % similar Ethylvanillin propylene glycol acetal68527-76-445 % similar Benzaldehyde dimethyl acetal1125-88-845 % similar (+)-Styrene oxide20780-53-445 % similar (S)-Styrene oxide20780-54-545 % similar Methyl 4,6-O-benzylidene-α-D-glucopyranoside3162-96-744 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4′-Hydroxybutyrophenone1009-11-6 Ethyl phenylacetate101-97-3 Methyl 3-phenylpropionate103-25-3 Phenethyl acetate103-45-7 Ethyl 3-methylbenzoate120-33-2 1-(4-Methoxyphenyl)-1-propanone121-97-1 Benzyl propionate122-63-4 4-Methoxyphenylacetone122-84-9

Elsewhere

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