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100991-92-2

100991-92-2 structural image
Product Name: 1,4-DIDEOXY-1,4-IMINO-D-ARABINITOL HYDROCHLORIDE
Formula: C5H12ClNO3
Synonyms: 2-Hydroxymethyl-3,4-pyrrolidinediol hydrochloride
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COMPUTED DESCRIPTORS

Molecular Weight 169.61 g/mol
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 169.0505709 g/mol
Monoisotopic Mass 169.0505709 g/mol
Topological Polar Surface Area 72.7 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 98.2
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

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