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Home > Nitro Compounds > 74927-72-3
74927-72-3 | (R)-(-)-N-(3,5-Dinitrobenzoyl)-alpha-phenylglycine , 98%
CAS No: 74927-72-3 Catalog No: AG003C3H MDL No:MFCD00010134
Product Description
Catalog Number:
AG003C3H
Chemical Name:
(R)-(-)-N-(3,5-Dinitrobenzoyl)-alpha-phenylglycine , 98%
CAS Number:
74927-72-3
Molecular Formula:
C15H11N3O7
Molecular Weight:
345.2637
MDL Number:
MFCD00010134
IUPAC Name:
(2R)-2-[(3,5-dinitrobenzoyl)amino]-2-phenylacetic acid
InChI:
InChI=1S/C15H11N3O7/c19-14(16-13(15(20)21)9-4-2-1-3-5-9)10-6-11(17(22)23)8-12(7-10)18(24)25/h1-8,13H,(H,16,19)(H,20,21)/t13-/m1/s1
InChI Key:
MIVUDAUOXJDARR-CYBMUJFWSA-N
SMILES:
OC(=O)[C@@H](c1ccccc1)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
345.06g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
345.267g/mol
Monoisotopic Mass:
345.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Solvation of phenylglycine- and leucine-derived chiral stationary phases: molecular dynamics simulation study. | The journal of physical chemistry. B 20081016 |
| A screening method for chiral selectors that does not require covalent attachment. | Journal of the American Chemical Society 20060222 |
| Capillary electrophoresis with (R)-(--)-N-(3,5-dinitrobenzoyl)-alpha-phenylglycine as chiral selector for separation of albendazole sulfoxide enantiomers and their analysis in human plasma. | Journal of pharmaceutical and biomedical analysis 20020115 |
| QSAR of matrix metalloproteinase inhibitor N-[(substituted phenyl)sulfonyl]-N-4-nitrobenzylglycine hydroxamates using LFER model. | Drug design and discovery 20010101 |
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