Home Aminos 2-Amino-4-oxo-4-(phenylamino)butanoic acid

2-Amino-4-oxo-4-(phenylamino)butanoic acid

CAS No.:
1220953-95-6
Catalog Number:
AG009DWH
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG009DWH
Chemical Name:
2-Amino-4-oxo-4-(phenylamino)butanoic acid
CAS Number:
1220953-95-6
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD03826904
IUPAC Name:
2-amino-4-anilino-4-oxobutanoic acid
InChI:
InChI=1S/C10H12N2O3/c11-8(10(14)15)6-9(13)12-7-4-2-1-3-5-7/h1-5,8H,6,11H2,(H,12,13)(H,14,15)
InChI Key:
MPAUCEQZKGWZGT-UHFFFAOYSA-N
SMILES:
NC(C(=O)O)CC(=O)Nc1ccccc1
NSC Number:
529142
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2  
Properties