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7586-94-9

7586-94-9 structural image
Product Name: N-TERT-BUTOXYCARBONYL-L-ALANINE-2,4,5-TRICHLOROPHENYL ESTER
Formula: C14H16Cl3NO4
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COMPUTED DESCRIPTORS

Molecular Weight 368.6 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 367.014491 g/mol
Monoisotopic Mass 367.014491 g/mol
Topological Polar Surface Area 64.6 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 413
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes