chempirical

2-(Benzyloxy)benzoic acid

C14H12O3CAS 14389-86-7228.25 g/mol

Open in Covalent MOL file
OHOO
Carboxylic acidEther

Properties

Molecular formula
C14H12O3
Molar mass
228.25 g/mol
Exact mass
228.0786 Da
Melting point
77 °C
logP
2.96Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
4

Identifiers

CAS number
14389-86-7
SMILES
O=C(O)c1ccccc1OCc1ccccc1
InChIKey
GMOYUTKNPLBTMT-UHFFFAOYSA-N
InChI
InChI=1S/C14H12O3/c15-14(16)12-8-4-5-9-13(12)17-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,16)

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

Names and synonyms

7 names
  • Benzoic acid, 2-(phenylmethoxy)-
  • Benzoic acid, o-(benzyloxy)-
  • 2-(Phenylmethoxy)benzoic acid
  • Salicylic acid benzyl ether
  • o-(Benzyloxy)benzoic acid
  • O-Benzylsalicylic acid
  • 2-[(Phenylmethyl)oxy]benzoic acid

Work with 2-(Benzyloxy)benzoic 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

2-Ethoxybenzoic acid134-11-264 % similar 2-(Carboxymethoxy)benzoic acid635-53-062 % similar 2-Propoxybenzoic acid2100-31-461 % similar Monobenzyl phthalate2528-16-761 % similar 2-Phenoxybenzoic acid2243-42-758 % similar 2-Bromo-4-methoxy-5-(phenylmethoxy)benzoic acid24958-42-757 % similar 3,5-Bis(phenylmethoxy)benzoic acid28917-43-356 % similar O-Anisic acid579-75-956 % 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 4-(Benzyloxy)benzoic acid1486-51-7 Desmethoxyyangonin15345-89-8 2′-Methoxy[1,1′-biphenyl]-3-carboxylic acid168618-47-1 Phenyl phenylmethyl carbonate28170-07-2 2,4-Dihydroxyphenyl benzyl ketone3669-41-8

Elsewhere

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