Benzeneethanesulfonic acid, b-(aminomethyl)-4-chloro-


Chemical Name: Benzeneethanesulfonic acid, b-(aminomethyl)-4-chloro-
CAS Number: 125464-42-8
Product Number: AG000NPW(AGN-PC-0PI22M)
Synonyms:
MDL No:
Molecular Formula: C9H12ClNO3S
Molecular Weight: 249.7145

Identification/Properties


Computed Properties
Molecular Weight:
249.709g/mol
XLogP3:
-1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
249.023g/mol
Monoisotopic Mass:
249.023g/mol
Topological Polar Surface Area:
88.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
280
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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