2-Methoxy-5-(trifluoromethyl)benzaldehyde

C₉H₇F₃O₂CAS 146539-83-5204.15 g/mol

Open in Covalent MOL file

Aldehyde Alkyl halide Ether

Properties

Molecular formula: C₉H₇F₃O₂
Molar mass: 204.15 g/mol
Exact mass: 204.0398 Da
logP: 2.53Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Identifiers

CAS number

146539-83-5

SMILES

COC1=C(C=C(C=C1)C(F)(F)F)C=O

InChIKey

WFRURKYDETYZGF-UHFFFAOYSA-N

InChI

InChI=1S/C9H7F3O2/c1-14-8-3-2-7(9(10,11)12)4-6(8)5-13/h2-5H,1H3

Weigh it out

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

Work with 2-Methoxy-5-(trifluoromethyl)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

2-Methoxy-5-(trifluoromethoxy)benzaldehyde145742-65-062 % similar 2,5-Dimethoxybenzaldehyde93-02-760 % similar 5-Fluoro-2-methoxybenzaldehyde19415-51-159 % similar 2,5-Bis(trifluoromethyl)benzaldehyde395-64-258 % similar 5-Bromo-2-methoxybenzaldehyde25016-01-757 % similar 2-Methoxy-5-(trifluoromethyl)aniline349-65-557 % similar 2-Fluoro-4-(trifluoromethyl)benzaldehyde89763-93-957 % similar 5-Chloro-2-methoxybenzaldehyde7035-09-855 % similar

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

Same formula

4-Methoxy-2-(trifluoromethyl)benzaldehyde106312-36-1 4-Methyl-2-(trifluoromethyl)benzoic acid120985-64-0 2-Methyl-5-(trifluoromethyl)benzoic acid13055-63-5 2-Methoxy-4-(trifluoromethyl)benzaldehyde132927-09-4 4'-Hydroxy-3'-(trifluoromethyl)acetophenone149105-11-3 Methyl 3-trifluoromethylbenzoate2557-13-3 4-Methyl-3-(trifluoromethyl)benzoic acid261952-01-6 [2-(Trifluoromethyl)phenyl]acetic acid3038-48-0

Elsewhere

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