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1135282-77-7

1135282-77-7 structural image
Product Name: tert-Butyl 2-(hydroxymethyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carboxylate
Formula: C13H21N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 267.32 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 267.15829154 g/mol
Monoisotopic Mass 267.15829154 g/mol
Topological Polar Surface Area 67.6 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 330
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 1
Compound Is Canonicalized Yes