chempirical

3-(3-Methoxyphenyl)benzaldehyde

C14H12O2CAS 126485-58-3212.25 g/mol

Open in Covalent MOL file
OO
AldehydeEther

Properties

Molecular formula
C14H12O2
Molar mass
212.25 g/mol
Exact mass
212.0837 Da
logP
3.17Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Identifiers

CAS number
126485-58-3
SMILES
COC1=CC=CC(=C1)C2=CC=CC(=C2)C=O
InChIKey
GLGWNAPAIMXRGT-UHFFFAOYSA-N
InChI
InChI=1S/C14H12O2/c1-16-14-7-3-6-13(9-14)12-5-2-4-11(8-12)10-15/h2-10H,1H3

Weigh it out

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Work with 3-(3-Methoxyphenyl)benzaldehyde

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3′,4′-Dimethoxy[1,1′-biphenyl]-3-carboxaldehyde676348-36-071 % similar 3-(4-Methoxyphenoxy)benzaldehyde62373-80-264 % similar [1,1′-Biphenyl]-3-carboxaldehyde1204-60-059 % similar 3-(4-Methylphenyl)benzaldehyde116470-54-356 % similar 6-Methoxy-2-naphthaldehyde3453-33-656 % similar 3′,4′-Dimethyl[1,1′-biphenyl]-3-carboxaldehyde343604-07-954 % similar 4-Anisaldehyde123-11-552 % similar 3,5-Dimethoxybenzaldehyde7311-34-452 % similar

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

Same formula

Diphenylacetic acid117-34-0 4'-Methoxy-[1,1'-biphenyl]-3-carbaldehyde118350-17-7 Benzoin (organic compound)119-53-9 Benzyl benzoate120-51-4 3-(2-Methoxyphenyl)benzaldehyde122801-57-4 2-Hydroxy-5-methylbenzophenone1470-57-1 4'-Methylbiphenyl-3-carboxylic acid147404-69-1 p-Phenylphenyl acetate148-86-7

Elsewhere

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