4'-Methoxy-biphenyl-3-carboxylic acid

C₁₄H₁₂O₃CAS 725-05-3228.25 g/mol

Open in Covalent MOL file

Carboxylic acid Ether

Properties

Molecular formula: C₁₄H₁₂O₃
Molar mass: 228.25 g/mol
Exact mass: 228.0786 Da
logP: 3.06Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

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

725-05-3

SMILES

COC1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)O

InChIKey

VWDMBLJBLIUXFS-UHFFFAOYSA-N

InChI

InChI=1S/C14H12O3/c1-17-13-7-5-10(6-8-13)11-3-2-4-12(9-11)14(15)16/h2-9H,1H3,(H,15,16)

Weigh it out

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Work with 4'-Methoxy-biphenyl-3-carboxylic acid

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

3'-Methoxy-biphenyl-4-carboxylic acid5783-36-874 % similar 3′,4′-Dimethoxy[1,1′-biphenyl]-3-carboxylic acid676348-31-572 % similar 4'-Methoxy(1,1'-biphenyl)-4-carboxylic acid725-14-471 % similar 3-Methoxybenzoic acid586-38-969 % similar 4'-Methylbiphenyl-3-carboxylic acid147404-69-166 % similar [1,1′-Biphenyl]-3-carboxylic acid716-76-766 % similar 4'-Chloro-biphenyl-3-carboxylic acid4655-10-163 % similar p-Anisic acid100-09-463 % similar

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

Same formula

Benzyl salicylate118-58-1 Oxybenzone131-57-7 2-(4-Phenylphenoxy)acetic acid13333-86-3 2-(Benzyloxy)benzoic acid14389-86-7 4-(Benzyloxy)benzoic acid1486-51-7 Desmethoxyyangonin15345-89-8 3'-Methoxy-biphenyl-3-carboxylic acid168618-45-9 2′-Methoxy[1,1′-biphenyl]-3-carboxylic acid168618-47-1

Elsewhere

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