chempirical

3-(3-Amino-2-hydroxyphenyl)benzoic acid

C13H11NO3CAS 376592-93-7229.23 g/mol

Open in Covalent MOL file
OOHNH2OH
Carboxylic acidPhenolPrimary amine

Properties

Molecular formula
C13H11NO3
Molar mass
229.23 g/mol
Exact mass
229.0739 Da
logP
2.34Crippen estimate
Polar surface area
83.5 Ų
H-bond donors / acceptors
3 / 3
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
376592-93-7
SMILES
C1=CC(=CC(=C1)C(=O)O)C2=C(C(=CC=C2)N)O
InChIKey
ZXLYSSHNDUXXIN-UHFFFAOYSA-N
InChI
InChI=1S/C13H11NO3/c14-11-6-2-5-10(12(11)15)8-3-1-4-9(7-8)13(16)17/h1-7,15H,14H2,(H,16,17)

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Names and synonyms

1 names
  • 3''-Amino-2''-hydroxy-biphenyl-3-carboxylic acid

Work with 3-(3-Amino-2-hydroxyphenyl)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′-Hydroxy-3′-nitro[1,1′-biphenyl]-3-carboxylic acid376591-95-660 % similar 2'-Chloro-biphenyl-3-carboxylic acid168619-03-259 % similar 2'-Fluorobiphenyl-3-carboxylic acid103978-23-056 % similar 2′-Methoxy[1,1′-biphenyl]-3-carboxylic acid168618-47-156 % similar 3-Aminosalicylic acid570-23-055 % similar [1,1′-Biphenyl]-3-carboxylic acid716-76-754 % similar 3'-Methyl-biphenyl-3-carboxylic acid158619-46-652 % similar 2'-Trifluoromethyl-biphenyl-3-carboxylic acid168618-48-252 % similar

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

Same formula

Phenyl 4-aminosalicylate133-11-9 4-Methoxy-4'-nitrobiphenyl2143-90-0 Osalmid526-18-1

Elsewhere

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