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Home > Nitro Compounds > 500991-88-8
500991-88-8 | Butanamide, N-(2-hydroxy-4-nitrophenyl)-
CAS No: 500991-88-8 Catalog No: AG006W00 MDL No:
Product Description
Catalog Number:
AG006W00
Chemical Name:
Butanamide, N-(2-hydroxy-4-nitrophenyl)-
CAS Number:
500991-88-8
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
IUPAC Name:
N-(2-hydroxy-4-nitrophenyl)butanamide
InChI:
InChI=1S/C10H12N2O4/c1-2-3-10(14)11-8-5-4-7(12(15)16)6-9(8)13/h4-6,13H,2-3H2,1H3,(H,11,14)
InChI Key:
YPKOXFIOZTVYDT-UHFFFAOYSA-N
SMILES:
CCCC(=O)Nc1ccc(cc1O)[N+](=O)[O-]
Properties
Complexity:
264
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:
4
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:
1.4
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