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120447-62-3

120447-62-3 structural image
Product Name: (+/-)-VESAMICOL HYDROCHLORIDE
Formula: C17H26ClNO
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 164.3 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

COMPUTED DESCRIPTORS

Molecular Weight 295.8 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 295.1702921 g/mol
Monoisotopic Mass 295.1702921 g/mol
Topological Polar Surface Area 23.5 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 266
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes