4-(2-Methoxyphenyl)benzaldehyde

C₁₄H₁₂O₂CAS 421553-62-0212.25 g/mol

Open in Covalent MOL file

Aldehyde Ether

Properties

Molecular formula: C₁₄H₁₂O₂
Molar mass: 212.25 g/mol
Exact mass: 212.0837 Da
logP: 3.17Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed66.7% of notifiers
H312 Harmful in contact with skin66.7% of notifiers
H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H332 Harmful if inhaled66.7% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

421553-62-0

SMILES

COC1=CC=CC=C1C2=CC=C(C=C2)C=O

InChIKey

CFGCKFDEJVKBCY-UHFFFAOYSA-N

InChI

InChI=1S/C14H12O2/c1-16-14-5-3-2-4-13(14)12-8-6-11(10-15)7-9-12/h2-10H,1H3

Weigh it out

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

Names and synonyms

1 names

2'-Methoxy-[1,1'-biphenyl]-4-carbaldehyde

Work with 4-(2-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

2-Methoxybiphenyl86-26-061 % similar 3',4'-Dimethoxybiphenyl-4-carbaldehyde640769-65-958 % similar 2′-Methyl[1,1′-biphenyl]-4-carboxaldehyde108934-21-057 % similar 4'-Methoxy-(1,1'-biphenyl)-4-carboxaldehyde52988-34-856 % similar 2,2'-Dimethoxy-6-formylbiphenyl87306-84-155 % similar 2,2'-Dimethoxybiphenyl4877-93-453 % similar 2-Methoxybenzaldehyde135-02-453 % similar 2'-Fluorobiphenyl-4-carbaldehyde57592-42-453 % 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 3-(3-Methoxyphenyl)benzaldehyde126485-58-3 2-Hydroxy-5-methylbenzophenone1470-57-1 4'-Methylbiphenyl-3-carboxylic acid147404-69-1

Elsewhere

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