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

2-methyl-2-[(4-nitrophenyl)amino]propanoic acid

CAS No.:
1215813-40-3
Catalog Number:
AG01AAQJ
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
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Product Description
Catalog Number:
AG01AAQJ
Chemical Name:
2-methyl-2-[(4-nitrophenyl)amino]propanoic acid
CAS Number:
1215813-40-3
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD14608333
IUPAC Name:
2-methyl-2-(4-nitroanilino)propanoic acid
InChI:
InChI=1S/C10H12N2O4/c1-10(2,9(13)14)11-7-3-5-8(6-4-7)12(15)16/h3-6,11H,1-2H3,(H,13,14)
InChI Key:
OLVSJCXKKXRGLO-UHFFFAOYSA-N
SMILES:
OC(=O)C(Nc1ccc(cc1)[N+](=O)[O-])(C)C
Properties
Complexity:
277  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties