2-Aminoresorcinol

C6H7NO2CAS 3163-15-3125.13 g/mol

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NH2OHHO
PhenolPrimary amine

Properties

Molecular formula
C6H7NO2
Molar mass
125.13 g/mol
Exact mass
125.0477 Da
Melting point
above 200 °C (decomposes)
logP
0.68Crippen estimate
Polar surface area
66.5 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
3163-15-3
SMILES
Nc1c(O)cccc1O
InChIKey
JEPCLNGRAIMPQV-UHFFFAOYSA-N
InChI
InChI=1S/C6H7NO2/c7-6-4(8)2-1-3-5(6)9/h1-3,8-9H,7H2

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Names and synonyms

6 names
  • 1,3-Benzenediol, 2-amino-
  • Resorcinol, 2-amino-
  • 2-Amino-1,3-benzenediol
  • 2,6-Dihydroxyaniline
  • 2-Aminoresorcin
  • 2-Aminobenzene-1,3-diol

Work with 2-Aminoresorcinol

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Aminoresorcinol hydrochloride634-60-6Salt

Similar compounds

2,3-Diaminophenol59649-56-871 % similar 2-Amino-3-bromophenol116435-77-968 % similar 2-Amino-3-methylphenol2835-97-465 % similar 2-Amino-3-fluorophenol53981-23-065 % similar 3-Hydroxyanthranilic acid548-93-654 % similar 2′-Amino-3′-hydroxyacetophenone4502-10-752 % similar 2-Amino-3-nitrophenol603-85-052 % similar Catechol120-80-950 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Cyanoethyl acrylate106-71-8 4-Methoxypyridine N-oxide1122-96-9 Methyl 2-pyrrolecarboxylate1193-62-0 N-Ethylmaleimide128-53-0 2-Propen-1-yl 2-cyanoacetate13361-32-5 4-Methylpyrrole-2-carboxylic acid18711-59-6 3-Methoxy-2(1H)-pyridinone20928-63-6 4-Hydroxy-6-methyl-2(1H)-pyridinone3749-51-7

Elsewhere

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