Home Aminos methyl 2-[(4-nitrophenyl)amino]propanoate

methyl 2-[(4-nitrophenyl)amino]propanoate

CAS No.:
1311383-63-7
Catalog Number:
AG01A3VM
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
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Product Description
Catalog Number:
AG01A3VM
Chemical Name:
methyl 2-[(4-nitrophenyl)amino]propanoate
CAS Number:
1311383-63-7
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD12189072
IUPAC Name:
methyl 2-(4-nitroanilino)propanoate
InChI:
InChI=1S/C10H12N2O4/c1-7(10(13)16-2)11-8-3-5-9(6-4-8)12(14)15/h3-7,11H,1-2H3
InChI Key:
IVJIPLQGUWDKSX-UHFFFAOYSA-N
SMILES:
COC(=O)C(Nc1ccc(cc1)[N+](=O)[O-])C
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties