2,2-Dimethyl-1-propylamine sulphate

C₅H₁₅NO₄SCAS 68306-49-0185.24 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₁₅NO₄S
Molar mass: 185.24 g/mol
Exact mass: 185.0722 Da
logP: 0.34Crippen estimate
Polar surface area: 100.6 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

68306-49-0

SMILES

CC(C)(C)CN.OS(=O)(=O)O

InChIKey

OORMCFJNCGHJGR-UHFFFAOYSA-N

InChI

InChI=1S/C5H13N.H2O4S/c1-5(2,3)4-6;1-5(2,3)4/h4,6H2,1-3H3;(H2,1,2,3,4)

Weigh it out

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Work with 2,2-Dimethyl-1-propylamine sulphate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Neopentylamine5813-64-9Free base

Similar compounds

Hydrazine sulfate10034-93-243 % similar Sulfuric acid7664-93-943 % similar Cystamine sulfate16214-16-741 % similar Hydroxylammonium sulfate10039-54-040 % similar Aminoacetonitrile bisulfate151-63-340 % similar Glycinonitrile sulfate (2:1)5466-22-840 % similar Methylhydrazine sulfate302-15-839 % similar Rhodium sulfate10489-46-038 % similar

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

Elsewhere

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