3-(Oxiran-2-ylmethoxy)benzaldehyde

C₁₀H₁₀O₃CAS 22590-64-3178.19 g/mol

Open in Covalent MOL file

Aldehyde Epoxide Ether

Properties

Molecular formula: C₁₀H₁₀O₃
Molar mass: 178.19 g/mol
Exact mass: 178.0630 Da
logP: 1.28Crippen estimate
Polar surface area: 38.8 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

22590-64-3

SMILES

C1C(O1)COC2=CC=CC(=C2)C=O

InChIKey

NAVUFVFBPAZJJT-UHFFFAOYSA-N

InChI

InChI=1S/C10H10O3/c11-5-8-2-1-3-9(4-8)12-6-10-7-13-10/h1-5,10H,6-7H2

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Work with 3-(Oxiran-2-ylmethoxy)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

Diglycidyl resorcinol ether101-90-666 % similar 3-Ethoxybenzaldehyde22924-15-859 % similar 3-Benzyloxybenzaldehyde1700-37-456 % similar 3-(2-Hydroxyethoxy)benzaldehyde60345-97-356 % similar Phenyl glycidyl ether122-60-153 % similar (2R)-2-(Phenoxymethyl)oxirane71031-02-253 % similar (2S)-2-(Phenoxymethyl)oxirane71031-03-353 % similar 3-(Difluoromethoxy)benzaldehyde85684-61-353 % similar

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

Same formula

trans-2-Methoxycinnamic acid1011-54-7 1-[4-(Acetyloxy)phenyl]ethanone13031-43-1 Ethyl benzoylformate1603-79-8 3-Methoxycinnamic acid17570-26-2 5-(2-Furyl)cyclohexane-1,3-dione1774-11-4 Methyl 4-hydroxycinnamate19367-38-5 3-Benzoylpropionic acid2051-95-8 2-(Acetyloxy)-1-phenylethanone2243-35-8

Elsewhere

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