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114645-19-1

114645-19-1 structural image
Product Name: N-alpha-t-Butyloxycarbonyl-L-isoleucinyl-diazomethane, (3S,4S)-3-Boc-amino-1-diazo-4-methyl-2-hexanone
Formula: C12H21N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 255.31 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 255.15829154 g/mol
Monoisotopic Mass 255.15829154 g/mol
Topological Polar Surface Area 57.4 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 354
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes