| CAS Number | 201152-47-8 |
| Catalog Number | AG002D8E(AGN-PC-0QRXQT) |
| Chemical Name | Boc-phg-osu |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetate |
| InChI | InChI=1S/C17H20N2O6/c1-17(2,3)24-16(23)18-14(11-7-5-4-6-8-11)15(22)25-19-12(20)9-10-13(19)21/h4-8,14H,9-10H2,1-3H3,(H,18,23)/t14-/m0/s1 |
| InChI Key | JPEHHKZULQJYEW-AWEZNQCLSA-N |
| MDL Number | MFCD00190826 |
| Molecular Formula | C17H20N2O6 |
| Molecular Weight | 348.3505 |
| SMILES | CC(C)(C)OC(=O)NC(C(=O)ON1C(=O)CCC1=O)C1=CC=CC=C1 |
| Synonyms | BOC-PHG-OSU,
201152-47-8,
SCHEMBL2484525,
(S)-2,5-Dioxopyrrolidin-1-yl 2-((tert-butoxycarbonyl)amino)-2-phenylacetate,
ZINC2556559,
6438AH,
MFCD00190826,
FT-0643876,
Boc-L-phenylglycine N-hydroxysuccinimide ester,
K-5879,
C-20557,
(S)-2,5-dioxopyrrolidin-1-yl 2-(tert-butoxycarbonylamino)-2-phenylacetate,
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-, 2,5-dioxo-1-pyrrolidinyl ester, (alphaS)-,
C17H20N2O6,
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| Complexity | 532 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 348.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 348.355g/mol |
| Monoisotopic Mass | 348.132g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 102A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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