Cystamine sulfate

C₄H₁₄N₂O₄S₃CAS 16214-16-7250.35 g/mol

Open in Covalent MOL file

Disulfide Primary amine

Properties

Molecular formula: C₄H₁₄N₂O₄S₃
Molar mass: 250.35 g/mol
Exact mass: 250.0116 Da
logP: -0.37Crippen estimate
Polar surface area: 126.6 Å²
H-bond donors / acceptors: 4 / 6
Rotatable bonds: 5

Hazards

Warning

H302 Harmful if swallowed100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number

16214-16-7

SMILES

NCCSSCCN.O=S(=O)(O)O

InChIKey

XVCYODCCYCPADG-UHFFFAOYSA-N

InChI

InChI=1S/C4H12N2S2.H2O4S/c5-1-3-7-8-4-2-6;1-5(2,3)4/h1-6H2;(H2,1,2,3,4)

Weigh it out

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

Names and synonyms

3 names

Ethanamine, 2,2′-dithiobis-, sulfate (1:?)
Ethylamine, 2,2′-dithiobis-, sulfate
Ethanamine, 2,2′-dithiobis-, sulfate

Work with Cystamine 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

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.

Cystamine dihydrochloride56-17-7Salt

Similar compounds

Hydrazine sulfate10034-93-245 % similar Sulfuric acid7664-93-945 % similar Hydroxylammonium sulfate10039-54-042 % similar Aminoacetonitrile bisulfate151-63-341 % similar Glycinonitrile sulfate (2:1)5466-22-841 % similar 2,2-Dimethyl-1-propylamine sulphate68306-49-041 % similar Rhodium sulfate10489-46-039 % similar Palladium sulfate (PdSO4)13566-03-539 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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