Home Other Building Blocks TERT-BUTYL 2-AMINO-3-(4-NITROPHENYL)PROPANOATE

TERT-BUTYL 2-AMINO-3-(4-NITROPHENYL)PROPANOATE

CAS No.:
1266369-25-8
Catalog Number:
AG01EJHO
Molecular Formula:
C13H18N2O4
Molecular Weight:
266.2930
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Product Description
Catalog Number:
AG01EJHO
Chemical Name:
TERT-BUTYL 2-AMINO-3-(4-NITROPHENYL)PROPANOATE
CAS Number:
1266369-25-8
Molecular Formula:
C13H18N2O4
Molecular Weight:
266.2930
MDL Number:
MFCD25899537
IUPAC Name:
tert-butyl 2-amino-3-(4-nitrophenyl)propanoate
InChI:
InChI=1S/C13H18N2O4/c1-13(2,3)19-12(16)11(14)8-9-4-6-10(7-5-9)15(17)18/h4-7,11H,8,14H2,1-3H3
InChI Key:
WFXHVZZCTZMYSA-UHFFFAOYSA-N
SMILES:
NC(C(=O)OC(C)(C)C)Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.127g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
266.297g/mol
Monoisotopic Mass:
266.127g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties