2,3-Diaminophenol

C6H8N2OCAS 59649-56-8124.14 g/mol

Open in Covalent MOL file
HONH2NH2
PhenolPrimary amine

Properties

Molecular formula
C6H8N2O
Molar mass
124.14 g/mol
Exact mass
124.0637 Da
logP
0.56Crippen estimate
Polar surface area
72.3 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
59649-56-8
SMILES
C1=CC(=C(C(=C1)O)N)N
InChIKey
PCAXITAPTVOLGL-UHFFFAOYSA-N
InChI
InChI=1S/C6H8N2O/c7-4-2-1-3-5(9)6(4)8/h1-3,9H,7-8H2

Weigh it out

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

Work with 2,3-Diaminophenol

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-Aminoresorcinol3163-15-371 % similar 2-Aminoresorcinol hydrochloride634-60-663 % similar 2-Aminophenol95-55-661 % similar 2-Amino-3-bromophenol116435-77-958 % similar 2-Amino-o-cresol53222-92-758 % similar 5-Amino-1-naphthol83-55-658 % similar 2-Amino-3-methylphenol2835-97-456 % similar 2-Amino-3-fluorophenol53981-23-056 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-5-methoxypyridine10167-97-2 2-Amino-4-methoxypyridine10201-73-7 (2-Aminopyridin-4-yl)methanol105250-17-7 2-Hydroxy-4,6-dimethylpyrimidine108-79-2 (6-Amino-3-pyridinyl)methanol113293-71-3 4-Aminopyridine-3-methanol138116-34-4 Bis(2-cyanoethyl) ether1656-48-0 2-Amino-6-methoxypyridine17920-35-3

Elsewhere

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