1,2-Benzisothiazole, 3-(1-piperazinyl)-, hydrochloride


Chemical Name: 1,2-Benzisothiazole, 3-(1-piperazinyl)-, hydrochloride
CAS Number: 144010-02-6
Product Number: AG001ISI(AGN-PC-00ASXZ)
Synonyms:
MDL No: MFCD00674131
Molecular Formula: C11H14ClN3S
Molecular Weight: 255.7670

Identification/Properties


Computed Properties
Molecular Weight:
255.764g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
255.06g/mol
Monoisotopic Mass:
255.06g/mol
Topological Polar Surface Area:
56.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
218
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:
2
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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