chempirical

Melitracen hydrochloride

C21H26ClNCAS 10563-70-9327.90 g/mol

Open in Covalent MOL file
NHCl
AlkeneTertiary amine

Properties

Molecular formula
C21H26ClN
Molar mass
327.90 g/mol
Exact mass
327.1754 Da
Melting point
245–248 °C
logP
5.13Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Identifiers

CAS number
10563-70-9
SMILES
CN(C)CCC=C1c2ccccc2C(C)(C)c2ccccc21.Cl
InChIKey
RADLXCPDUXFGFF-UHFFFAOYSA-N
InChI
InChI=1S/C21H25N.ClH/c1-21(2)19-13-7-5-10-17(19)16(12-9-15-22(3)4)18-11-6-8-14-20(18)21;/h5-8,10-14H,9,15H2,1-4H3;1H

Weigh it out

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

Names and synonyms

7 names
  • 1-Propanamine, 3-(10,10-dimethyl-9(10H)-anthracenylidene)-N,N-dimethyl-, hydrochloride (1:1)
  • δ9(10H),γ-Anthracenepropylamine, N,N,10,10-tetramethyl-, hydrochloride
  • 1-Propanamine, 3-(10,10-dimethyl-9(10H)-anthracenylidene)-N,N-dimethyl-, hydrochloride
  • 9-(3-Dimethylaminopropylidene)-10,10-dimethyl-9,10-dihydroanthracene hydrochloride
  • U 24973A
  • Melixeran
  • Dixeran

Work with Melitracen hydrochloride

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

Amitriptyline hydrochloride549-18-864 % similar Cyclobenzaprine hydrochloride6202-23-964 % similar Amitriptyline50-48-657 % similar Doxepin hydrochloride1229-29-455 % similar Chlorprothixene hydrochloride6469-93-854 % similar Chlorprothixene113-59-748 % similar Olopatadine hydrochloride140462-76-642 % similar 10,10-Dimethyl-9(10H)-anthracenone5447-86-940 % similar

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

Same formula

Terbinafine hydrochloride78628-80-5

Elsewhere

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