chempirical

Dianol

C6H10Cl2N2OCAS 137-09-7197.06 g/mol

Open in Covalent MOL file
HClHClH2NOHNH2
PhenolPrimary amine

Properties

Molecular formula
C6H10Cl2N2O
Molar mass
197.06 g/mol
Exact mass
196.0170 Da
Melting point
205 °C
logP
1.40Crippen estimate
Polar surface area
72.3 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
0

Identifiers

CAS number
137-09-7
SMILES
Cl.Cl.Nc1ccc(O)c(N)c1
InChIKey
KQEIJFWAXDQUPR-UHFFFAOYSA-N
InChI
InChI=1S/C6H8N2O.2ClH/c7-4-1-2-6(9)5(8)3-4;;/h1-3,9H,7-8H2;2*1H

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Names and synonyms

8 names
  • Phenol, 2,4-diamino-, hydrochloride (1:2)
  • Phenol, 2,4-diamino-, dihydrochloride
  • Amidol
  • Acrol
  • Diamidophenol hydrochloride
  • 2,4-Diaminophenol dihydrochloride
  • 2,4-Diaminophenol hydrochloride
  • Amidol dihydrochloride

Work with Dianol

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

Phenol, 2,4-diamino-, sulfate (1:?)74283-34-465 % similar 1,2,4-Triaminobenzene dihydrochloride615-47-462 % similar Phenol, 2,2′-methylenebis[4-amino-, hydrochloride (1:2)27311-52-060 % similar 4,6-Diaminoresorcinol dihydrochloride16523-31-258 % similar o-Aminophenol hydrochloride51-19-454 % similar 4-Amino-2-bromophenol16750-67-750 % similar 4-Amino-2-methylphenol2835-96-350 % similar 4-Amino-2-chlorophenol3964-52-150 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook