1-(3-methylsulfonylpropyl)piperazine;dihydrochloride


Chemical Name: 1-(3-methylsulfonylpropyl)piperazine;dihydrochloride
CAS Number: 939983-66-1
Product Number: AG00GSOX(AGN-PC-088Q14)
Synonyms:
MDL No:
Molecular Formula: C8H20Cl2N2O2S
Molecular Weight: 279.2276

Identification/Properties


Computed Properties
Molecular Weight:
279.22g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
278.062g/mol
Monoisotopic Mass:
278.062g/mol
Topological Polar Surface Area:
57.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
227
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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