3′,4′-Dimethyl[1,1′-biphenyl]-3-carboxaldehyde

C15H14OCAS 343604-07-9210.28 g/mol

Open in Covalent MOL file
O
Aldehyde

Properties

Molecular formula
C15H14O
Molar mass
210.28 g/mol
Exact mass
210.1045 Da
logP
3.78Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

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
343604-07-9
SMILES
Cc1ccc(-c2cccc(C=O)c2)cc1C
InChIKey
XBVSMPXCQQMBOG-UHFFFAOYSA-N
InChI
InChI=1S/C15H14O/c1-11-6-7-15(8-12(11)2)14-5-3-4-13(9-14)10-16/h3-10H,1-2H3

Weigh it out

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

Names and synonyms

1 names
  • [1,1′-Biphenyl]-3-carboxaldehyde, 3′,4′-dimethyl-

Work with 3′,4′-Dimethyl[1,1′-biphenyl]-3-carboxaldehyde

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-(3,4-Dimethylphenyl)benzaldehyde343604-05-771 % similar 3-(4-Methylphenyl)benzaldehyde116470-54-367 % similar 3-(3-Methylphenyl)benzaldehyde216443-78-664 % similar 3,4-Dimethylbenzaldehyde5973-71-763 % similar [1,1′-Biphenyl]-3-carboxaldehyde1204-60-061 % similar 4'-Chlorobiphenyl-3-carbaldehyde139502-80-059 % similar 3-(4-Fluorophenyl)benzaldehyde164334-74-157 % similar 4'-Methoxy-[1,1'-biphenyl]-3-carbaldehyde118350-17-757 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Dibenzyl ketone102-04-5 Dihydrochalcone1083-30-3 2,4-Dimethylbenzophenone1140-14-3 4-Methoxystilbene1142-15-0 Dibenzosuberol1210-34-0 3,4'-Dimethylbenzophenone13152-94-8 4-Ethylbenzophenone18220-90-1 9,9-Dimethyl-9H-xanthene19814-75-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook