1,1-Dimethylethyl 5-Amino-5-oxo-4-[[(phenylmethoxy)carbonyl]amino]pentanoate - CAS 106571-82-8
Catalog: |
BB066523 |
Product Name: |
1,1-Dimethylethyl 5-Amino-5-oxo-4-[[(phenylmethoxy)carbonyl]amino]pentanoate |
CAS: |
106571-82-8 |
Synonyms: |
1,1-Dimethylethyl 5-Amino-5-oxo-4-[[(phenylmethoxy)carbonyl]amino]pentanoate; tert- Butyl 5- Amino- 4- (((benzyloxy) carbonyl) amino) - 5- oxopentanoate |
IUPAC Name: | tert-butyl 5-amino-5-oxo-4-(phenylmethoxycarbonylamino)pentanoate |
Description: | 1,1-Dimethylethyl 5-Amino-5-oxo-4-[[(phenylmethoxy)carbonyl]amino]pentanoate is a useful reagent for peptide synthesis. |
Molecular Weight: | 336.38 |
Molecular Formula: | C17H24N2O5 |
Canonical SMILES: | CC(C)(C)OC(=O)CCC(C(=O)N)NC(=O)OCC1=CC=CC=C1 |
InChI: | InChI=1S/C17H24N2O5/c1-17(2,3)24-14(20)10-9-13(15(18)21)19-16(22)23-11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H2,18,21)(H,19,22) |
InChI Key: | FVASJFMQBNYNSN-UHFFFAOYSA-N |
References: | Klieger, E., et al. Justus Liebigs Ann. Chem., 655, 195 (1962). |
Complexity: | 439 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 336.16852187 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 336.16852187 |
Rotatable Bond Count: | 10 |
Topological Polar Surface Area: | 108Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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