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Boc-D-Hyp-OtBu

CAT: 0024-sc-285145ASize: 250 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-285145ASize:250 mg
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CAS Number
862996-27-8

Chemical Information

Boc-D-Hyp-Otbu
CAS Number862996-27-8
PubChem CID56845308
IUPAC Nameditert-butyl (2R,4S)-4-hydroxypyrrolidine-1,2-dicarboxylate
Molecular FormulaC14H25NO5
Molecular Weight287.35
XLogP1.6
Topological Polar Surface Area76.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity380
SMILES
CC(C)(C)OC(=O)[C@H]1C[C@@H](CN1C(=O)OC(C)(C)C)O
InChI
InChI=1S/C14H25NO5/c1-13(2,3)19-11(17)10-7-9(16)8-15(10)12(18)20-14(4,5)6/h9-10,16H,7-8H2,1-6H3/t9-,10+/m0/s1
InChIKey
OXHIVNUWGSCHBD-VHSXEESVSA-N
Chemical Structure
2D Structure
2D structure of Boc-D-Hyp-Otbu
CAS: 862996-27-8
CID: 56845308
Formula: C14H25NO5
MW: 287.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight287.35
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass287.17327290
Monoisotopic Mass287.17327290
Topological Polar Surface Area76.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity380
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes