| CAS Number | 71989-17-8 |
| Catalog Number | AG00FATP(AGN-PC-0TZR2A) |
| Chemical Name | Fmoc-Asn-ONp |
| IUPAC Name | (4-nitrophenyl) (2S)-4-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoate |
| InChI | InChI=1S/C25H21N3O7/c26-23(29)13-22(24(30)35-16-11-9-15(10-12-16)28(32)33)27-25(31)34-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14H2,(H2,26,29)(H,27,31)/t22-/m0/s1 |
| InChI Key | MPNFRQBESOZRJG-QFIPXVFZSA-N |
| MDL Number | MFCD00063329 |
| Molecular Formula | C25H21N3O7 |
| Molecular Weight | 475.4501 |
| SMILES | NC(=O)C[C@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(=O)OC1=CC=C(C=C1)[N+]([O-])=O |
| Synonyms | Fmoc-Asn-ONp,
71989-17-8,
(S)-4-Nitrophenyl 2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-amino-4-oxobutanoate,
DTXSID90548946,
6790AH,
CF-169,
MFCD00063329,
ZINC71788061,
AKOS016014009,
AS-48995,
AX8001723,
FT-0641381,
C-22752,
9-fluorenylmethyloxycarbonyl-l-asparagine p-nitrophenyl ester,
4-Nitrophenyl N~2~-{[(9H-fluoren-9-yl)methoxy]carbonyl}-L-asparaginate,
Fmoc-Asn-ONp, purum, >=98.0% (calc. based on dry substance, C/N),
(S)-4-nitrophenyl 2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-4-amino-4-oxobutanoate,
C25H21N3O7,
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| Complexity | 770 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 475.138g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 35 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 475.457g/mol |
| Monoisotopic Mass | 475.138g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 154A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number