Dimethyl-p-phenylenediamine sulfate

C₈H₁₄N₂O₄SCAS 536-47-0234.27 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₈H₁₄N₂O₄S
Molar mass: 234.27 g/mol
Exact mass: 234.0674 Da
logP: 0.68Crippen estimate
Polar surface area: 103.9 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 1

Identifiers

CAS number

536-47-0

SMILES

CN(C)c1ccc(N)cc1.O=S(=O)(O)O

InChIKey

GLUKPDKNLKRLHX-UHFFFAOYSA-N

InChI

InChI=1S/C8H12N2.H2O4S/c1-10(2)8-5-3-7(9)4-6-8;1-5(2,3)4/h3-6H,9H2,1-2H3;(H2,1,2,3,4)

Weigh it out

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

Names and synonyms

4 names

1,4-Benzenediamine, N1,N1-dimethyl-, sulfate (1:1)
p-Phenylenediamine, N,N-dimethyl-, sulfate (1:1)
1,4-Benzenediamine, N,N-dimethyl-, sulfate (1:1)
N,N-Dimethyl-1,4-phenylenediamine sulfate

Work with Dimethyl-p-phenylenediamine sulfate

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

Benzene-1,4-diamine; hydroxy hydrogen sulfite16245-77-567 % similar Dimethyl-4-phenylenediamine99-98-967 % similar N,N-Dimethylanilinium hydrogen sulfate58888-49-665 % similar Diethyl-P-phenylenediamine sulfate6283-63-263 % similar p-Amino-N,N-dimethylaniline monohydrochloride2052-46-260 % similar N,N-Dimethyl-P-phenylenediamine dihydrochloride536-46-960 % similar N,N-Dimethyl-p-phenylenediamine oxalate24631-29-659 % similar N1,N1-Dimethyl-1,4-benzenediamine ethanedioate (2:1)62778-12-559 % similar

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

Same formula

N,N-Dimethyl-P-phenylenediamine sulfate6219-73-4

Elsewhere

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