4'-Methylbiphenyl-4-carbaldehyde

C14H12OCAS 36393-42-7196.25 g/mol

Open in Covalent MOL file
O
Aldehyde

Properties

Molecular formula
C14H12O
Molar mass
196.25 g/mol
Exact mass
196.0888 Da
logP
3.47Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number
36393-42-7
SMILES
CC1=CC=C(C=C1)C2=CC=C(C=C2)C=O
InChIKey
BCINBWXQYBLSKO-UHFFFAOYSA-N
InChI
InChI=1S/C14H12O/c1-11-2-6-13(7-3-11)14-8-4-12(10-15)5-9-14/h2-10H,1H3

Weigh it out

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

Names and synonyms

1 names
  • 4'-Methyl-[1,1'-biphenyl]-4-carbaldehyde

Work with 4'-Methylbiphenyl-4-carbaldehyde

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-Methylbenzaldehyde104-87-086 % similar [1,1′-Biphenyl]-4,4′-dicarboxaldehyde66-98-871 % similar 4-(Bis(p-tolyl)amino)benzaldehyde42906-19-467 % similar 1,3,5-Tris(4-formylphenyl)benzene118688-53-263 % similar [1,1′-Biphenyl]-4-carboxaldehyde3218-36-860 % similar 4-(3,4-Dimethylphenyl)benzaldehyde343604-05-759 % similar Di-p-tolyl613-33-257 % similar 1,4-Benzenedicarboxaldehyde623-27-857 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2′-Methyl[1,1′-biphenyl]-4-carboxaldehyde108934-21-0 3-(4-Methylphenyl)benzaldehyde116470-54-3 2-Methylbenzophenone131-58-8 4-Methylbenzophenone134-84-9 trans-Stilbene oxide1439-07-2 3-(3-Methylphenyl)benzaldehyde216443-78-6 Fluorene-9-methanol24324-17-2 4-(3-Methylphenyl)benzaldehyde400744-83-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook