1-(5-chloronaphthalen-1-yl)sulfonyl-1,4-diazepane;hydrochloride


Chemical Name: 1-(5-chloronaphthalen-1-yl)sulfonyl-1,4-diazepane;hydrochloride
CAS Number: 105637-50-1
Product Number: AG008RE3(AGN-PC-0JLG3W)
Synonyms:
MDL No: MFCD00065525
Molecular Formula: C15H18Cl2N2O2S
Molecular Weight: 361.2866

Identification/Properties


Computed Properties
Molecular Weight:
361.281g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
360.047g/mol
Monoisotopic Mass:
360.047g/mol
Topological Polar Surface Area:
57.8A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
451
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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