Boc-gly-PEG3-endo-BCN

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Boc-gly-PEG3-endo-BCN

Boc-gly-PEG3-endo-BCN | 2110444-63-6

Catelog Number R16-0002
Category BCN
Molecular Formula C28H47N3O8
Molecular Weight 553.69
Catalog Number Size Price Quantity
R16-0002 -- $--

Chemical Information

Synonyms Bicyclo[6.1.0]non-4-yn-9-ylmethyl tert-butyl (2-oxo-7,10,13-trioxa-3-azahexadecane-1,16-diyl)dicarbamate
Purity ≥95%
Shelf Life -20℃ 3 years powder; -80℃ 2 years in solvent
Canonical SMILES CC(C)(C)OC(=O)NCC(=O)NCCCOCCOCCOCCCNC(=O)OCC1C2C1CCC#CCC2
InChI InChI=1S/C28H47N3O8/c1-28(2,3)39-27(34)31-20-25(32)29-12-8-14-35-16-18-37-19-17-36-15-9-13-30-26(33)38-21-24-22-10-6-4-5-7-11-23(22)24/h22-24H,6-21H2,1-3H3,(H,29,32)(H,30,33)(H,31,34)
InChI Key SPXNLNQWLORDDS-UHFFFAOYSA-N
Solubility 10 mm in DMSO

Product Specification

Storage Store at -20 °C, keep in dry and avoid sunlight.

Computed Properties

XLogP3 2.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 21
Exact Mass 553.33631547 g/mol
Monoisotopic Mass 553.33631547 g/mol
Topological Polar Surface Area 133Ų
Heavy Atom Count 39
Formal Charge 0
Complexity 799
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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