4,4′-Bis(dimethylamino)benzhydrol

C17H22N2OCAS 119-58-4270.38 g/mol

Open in Covalent MOL file
NOHN
AlcoholTertiary amine

Properties

Molecular formula
C17H22N2O
Molar mass
270.38 g/mol
Exact mass
270.1732 Da
Melting point
98–100 °C
logP
2.90Crippen estimate
Polar surface area
26.7 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
119-58-4
SMILES
CN(C)c1ccc(C(O)c2ccc(N(C)C)cc2)cc1
InChIKey
YLZSIUVOIFJGQZ-UHFFFAOYSA-N
InChI
InChI=1S/C17H22N2O/c1-18(2)15-9-5-13(6-10-15)17(20)14-7-11-16(12-8-14)19(3)4/h5-12,17,20H,1-4H3

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Names and synonyms

14 names · show all
  • 4,4'-Bis(dimethylamino)benzhydrol
  • Benzenemethanol, 4-(dimethylamino)-α-[4-(dimethylamino)phenyl]-
  • Benzhydrol, 4,4′-bis(dimethylamino)-
  • Benzohydrol, 4,4′-bis(dimethylamino)-
  • 4-(Dimethylamino)-α-[4-(dimethylamino)phenyl]benzenemethanol
  • α,α-Bis(p-dimethylaminophenyl)methanol
  • Michler's hydrol
  • Tetramethyldiaminobenzhydrol
  • N,N′-Tetramethyl-4,4′-diaminobenzohydrol
  • 4,4′-Bis(dimethylamino)diphenylcarbinol
  • p,p′-Bis(dimethylamino)benzhydrol
  • 4,4′-Bis(dimethylamino)diphenylmethanol
  • NSC 3563
  • 4,4′-(Dimethylamino)benzhydrol

Work with 4,4′-Bis(dimethylamino)benzhydrol

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

Leucocrystal violet603-48-563 % similar Wurster's blue100-22-157 % similar Leucomalachite green129-73-754 % similar N,N,N',N'-Tetramethylbenzidine366-29-050 % similar Tetramethyl-p-phenylenediamine dihydrochloride637-01-450 % similar 4,4'-Dimethylbenzhydrol885-77-850 % similar 4,4′-Dichlorobenzhydrol90-97-150 % similar Dimethyl-p-toluidine99-97-846 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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