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Home Nitros Z-L-Aspartic acid 4-benzyl 1-(4-nitrophenyl) ester

Z-L-Aspartic acid 4-benzyl 1-(4-nitrophenyl) ester

CAS No.:
2419-54-7
Catalog Number:
AG00BGM7
Molecular Formula:
C25H22N2O8
Molecular Weight:
478.4508
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 97% (HPLC)
1 week
United States
$61
- +
5g
≥ 97% (HPLC)
1 week
United States
$99
- +
25g
≥ 97% (HPLC)
1 week
United States
$281
- +
Product Description
Catalog Number:
AG00BGM7
Chemical Name:
Z-L-Aspartic acid 4-benzyl 1-(4-nitrophenyl) ester
CAS Number:
2419-54-7
Molecular Formula:
C25H22N2O8
Molecular Weight:
478.4508
MDL Number:
MFCD00057618
IUPAC Name:
4-O-benzyl 1-O-(4-nitrophenyl) (2S)-2-(phenylmethoxycarbonylamino)butanedioate
InChI:
InChI=1S/C25H22N2O8/c28-23(33-16-18-7-3-1-4-8-18)15-22(26-25(30)34-17-19-9-5-2-6-10-19)24(29)35-21-13-11-20(12-14-21)27(31)32/h1-14,22H,15-17H2,(H,26,30)/t22-/m0/s1
InChI Key:
PDNCLFWZMMRDCA-QFIPXVFZSA-N
SMILES:
O=C(C[C@@H](C(=O)Oc1ccc(cc1)[N+](=O)[O-])NC(=O)OCc1ccccc1)OCc1ccccc1
Properties
Complexity:
705  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
478.138g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
478.457g/mol
Monoisotopic Mass:
478.138g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties