Pyronine

C₁₇H₁₉ClN₂OCAS 92-32-0302.80 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₇H₁₉ClN₂O
Molar mass: 302.80 g/mol
Exact mass: 302.1186 Da
logP: 1.00Crippen estimate
Polar surface area: 17.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Identifiers

CAS number

92-32-0

SMILES

CN(C)c1ccc2cc3ccc(N(C)C)cc3[o+]c2c1.[Cl-]

InChIKey

INCIMLINXXICKS-UHFFFAOYSA-M

InChI

InChI=1S/C17H19N2O.ClH/c1-18(2)14-7-5-12-9-13-6-8-15(19(3)4)11-17(13)20-16(12)10-14;/h5-11H,1-4H3;1H/q+1;/p-1

Weigh it out

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

Names and synonyms

15 names · show all

Xanthylium, 3,6-bis(dimethylamino)-, chloride (1:1)
Pyronine G
Ammonium, [6-(dimethylamino)-3H-xanthen-3-ylidene]dimethyl-, chloride
Methanaminium, N-[6-(dimethylamino)-3H-xanthen-3-ylidene]-N-methyl-, chloride
Xanthylium, 3,6-bis(dimethylamino)-, chloride
C.I. 45005
3,6-Bis(dimethylamino)xanthylium chloride
Pyronin G
Schultz no. 853
Pyronin Y
Pyronin yellow
Pyronine Y
Pyronine GS
Pyronin GS
Pyronine GY

Work with Pyronine

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

N,N,N′,N′-Tetramethylacridine-3,6-diamine monohydrochloride compd. with zinc dichloride10127-02-349 % similar Acridine orange494-38-248 % similar N,N-Dimethyl-2-naphthalenamine2436-85-347 % similar Methylene blue61-73-442 % similar Wurster'S blue100-22-141 % similar Methylene blue trihydrate7220-79-339 % similar N,N,N′,N′-Tetramethylbenzidine366-29-037 % similar Tetramethyl-P-phenylenediamine dihydrochloride637-01-437 % similar

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

Same formula

2-((4-Chlorophenyl)(4-piperidinyloxy)methyl)pyridine122368-54-1 5-(Benzyloxy)tryptamine monohydrochloride52055-23-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook