chempirical

2-(Carboxymethoxy)benzoic acid

C9H8O5CAS 635-53-0196.16 g/mol

Open in Covalent MOL file
OHOOOOH
Carboxylic acidEther

Properties

Molecular formula
C9H8O5
Molar mass
196.16 g/mol
Exact mass
196.0372 Da
Melting point
190 °C
logP
0.85Crippen estimate
Polar surface area
83.8 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
4

Identifiers

CAS number
635-53-0
SMILES
O=C(O)COc1ccccc1C(=O)O
InChIKey
JLLXSRLEXBECPY-UHFFFAOYSA-N
InChI
InChI=1S/C9H8O5/c10-8(11)5-14-7-4-2-1-3-6(7)9(12)13/h1-4H,5H2,(H,10,11)(H,12,13)

Weigh it out

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

Names and synonyms

7 names
  • Benzoic acid, 2-(carboxymethoxy)-
  • o-Anisic acid, α-carboxy-
  • o-(Carboxymethoxy)benzoic acid
  • Acetic acid, (2-carboxyphenoxy)-
  • (o-Carboxyphenoxy)acetic acid
  • (2-Carboxyphenoxy)acetic acid
  • NSC 1335

Work with 2-(Carboxymethoxy)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

Salicylamide O-acetic acid25395-22-672 % similar 1,2-Phenylenedioxydiacetic acid5411-14-371 % similar 2-Ethoxybenzoic acid134-11-264 % similar 2-(Benzyloxy)benzoic acid14389-86-762 % similar 2-Propoxybenzoic acid2100-31-461 % similar (2-Methylphenoxy)acetic acid1878-49-559 % similar 2-(2-Methoxyphenoxy)acetic acid1878-85-959 % similar O-Chlorophenoxyacetic acid614-61-959 % similar

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

Same formula

4-Methoxyphthalic acid1885-13-8 4-Methoxy-1,3-benzenedicarboxylic acid2206-43-1 3′,4′-Methylenedioxymandelic acid27738-46-1

Elsewhere

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