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90346-87-5

90346-87-5 structural image
Product Name: 7-chloro-2,3,4,5-tetrahydro-1,5-benzothiazepine
Formula: C9H10ClNS
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COMPUTED DESCRIPTORS

Molecular Weight 199.70 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 199.0222482 g/mol
Monoisotopic Mass 199.0222482 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 154
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 1
Compound Is Canonicalized Yes