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6170-42-9

6170-42-9 structural image
Product Name: Chloropyramine hydrochloride
Formula: C16H21Cl2N3
Synonyms: N-p-Chlorobenzyl-N′,N′-dimethyl-N-(2-pyridyl)ethylenediamine
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 167.9 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

COMPUTED DESCRIPTORS

Molecular Weight 326.3 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 325.1112531 g/mol
Monoisotopic Mass 325.1112531 g/mol
Topological Polar Surface Area 19.4 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 264
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