Home Aminos Butanoic acid,4-[(4-nitrophenyl)amino]-

Butanoic acid,4-[(4-nitrophenyl)amino]-

CAS No.:
87962-89-8
Catalog Number:
AG004G9K
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
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Product Description
Catalog Number:
AG004G9K
Chemical Name:
Butanoic acid,4-[(4-nitrophenyl)amino]-
CAS Number:
87962-89-8
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD07325339
IUPAC Name:
4-(4-nitroanilino)butanoic acid
InChI:
InChI=1S/C10H12N2O4/c13-10(14)2-1-7-11-8-3-5-9(6-4-8)12(15)16/h3-6,11H,1-2,7H2,(H,13,14)
InChI Key:
BTWRFZZFMXEFQG-UHFFFAOYSA-N
SMILES:
OC(=O)CCCNc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
244  
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:
5  
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties