4'-(3-Methyl-2-butyenyloxy)benzaldehyde

C₁₂H₁₄O₂CAS 28090-12-2190.24 g/mol

Open in Covalent MOL file

Aldehyde Alkene Ether

Properties

Molecular formula: C₁₂H₁₄O₂
Molar mass: 190.24 g/mol
Exact mass: 190.0994 Da
logP: 2.84Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
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

28090-12-2

SMILES

CC(=CCOC1=CC=C(C=C1)C=O)C

InChIKey

ZCAMZJYDORGUOV-UHFFFAOYSA-N

InChI

InChI=1S/C12H14O2/c1-10(2)7-8-14-12-5-3-11(9-13)4-6-12/h3-7,9H,8H2,1-2H3

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Names and synonyms

1 names

4-[(3-Methylbut-2-en-1-yl)oxy]benzaldehyde

Work with 4'-(3-Methyl-2-butyenyloxy)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

4-(Allyloxy)benzaldehyde40663-68-157 % similar 4-Ethoxybenzaldehyde10031-82-056 % similar 4-Propoxybenzaldehyde5736-85-653 % similar 4-Butoxybenzaldehyde5736-88-950 % similar (4-Formylphenoxy)acetic acid22042-71-349 % similar 4-(Pentyloxy)benzaldehyde5736-91-449 % similar 4-(2-Hydroxyethoxy)benzaldehyde22042-73-549 % similar 4-(Acetyloxy)benzaldehyde878-00-249 % similar

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

Same formula

Cinnamyl propionate103-56-0 1-(4-Methoxyphenyl)-1-penten-3-one104-27-8 4-(4′-Hydroxyphenyl)cyclohexanone105640-07-1 4-Vinylbenzyl glycidyl ether113538-80-0 1-Methyl-7-methoxy-2-tetralone1204-23-5 Ethyl 3-(4-methylphenyl)-2-propenoate20511-20-0 3-[4-(1-Methylethyl)phenyl]-2-propenoic acid3368-21-6 Benzyl tiglate37526-88-8

Elsewhere

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