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N-tert-Butoxycarbonyl-N-[3-(tert-butoxycarbonylamino)propyl]glycine - >98.0%(GC)(T), high purity , CAS No.192124-66-6
Basic Description
Synonyms | D88923 | DTXSID70443243 | B2293 | AS-74467 | Glycine, N-[(1,1-dimethylethoxy)carbonyl]-N-[3-[[(1,1-dimethylethoxy)carbonyl]amino]propyl]- | N-Boc-N-[3-(Boc-amino)propyl]glycine | 2-{[(tert-butoxy)carbonyl](3-{[(tert-butoxy)carbonyl]amino}propyl)amino}acet |
Specifications & Purity | ≥98%(GC)(T) |
Shipped In | Normal |
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Names and Identifiers
IUPAC Name | 2-[(2-methylpropan-2-yl)oxycarbonyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]acetic acid |
INCHI | InChI=1S/C15H28N2O6/c1-14(2,3)22-12(20)16-8-7-9-17(10-11(18)19)13(21)23-15(4,5)6/h7-10H2,1-6H3,(H,16,20)(H,18,19) |
InChi Key | ZYKFFIFTMKLYQJ-UHFFFAOYSA-N |
Canonical SMILES | CC(C)(C)OC(=O)NCCCN(CC(=O)O)C(=O)OC(C)(C)C |
Isomeric SMILES | CC(C)(C)OC(=O)NCCCN(CC(=O)O)C(=O)OC(C)(C)C |
PubChem CID | 10664315 |
Molecular Weight | 332.4 |
Reaxy-Rn | 7717791 |
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Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility | Slightly soluble in Methanol |
Melt Point(°C) | 120 °C |
Molecular Weight | 332.390 g/mol |
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XLogP3 | 1.800 |
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Hydrogen Bond Donor Count | 2 |
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Hydrogen Bond Acceptor Count | 6 |
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Rotatable Bond Count | 10 |
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Exact Mass | 332.195 Da |
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Monoisotopic Mass | 332.195 Da |
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Topological Polar Surface Area | 105.000 Ų |
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Heavy Atom Count | 23 |
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Formal Charge | 0 |
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Complexity | 423.000 |
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Isotope Atom Count | 0 |
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Defined Atom Stereocenter Count | 0 |
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Undefined Atom Stereocenter Count | 0 |
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Defined Bond Stereocenter Count | 0 |
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Undefined Bond Stereocenter Count | 0 |
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The total count of all stereochemical bonds | 0 |
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Covalently-Bonded Unit Count | 1 |
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