2,3,4,5-tetrahydro-1,4-benzothiazepine;hydrochloride


Chemical Name: 2,3,4,5-tetrahydro-1,4-benzothiazepine;hydrochloride
CAS Number: 14953-97-0
Product Number: AG001LT9(AGN-PC-03MMHY)
Synonyms:
MDL No:
Molecular Formula: C9H12ClNS
Molecular Weight: 201.7163

Identification/Properties


Computed Properties
Molecular Weight:
201.712g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
201.038g/mol
Monoisotopic Mass:
201.038g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
127
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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