Home Aminos 3-((4-Fluorophenyl)amino)-3-oxopropanoic acid

3-((4-Fluorophenyl)amino)-3-oxopropanoic acid

CAS No.:
95262-10-5
Catalog Number:
AG00IIWH
Molecular Formula:
C9H8FNO3
Molecular Weight:
197.1631
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$402
- +
Product Description
Catalog Number:
AG00IIWH
Chemical Name:
3-((4-Fluorophenyl)amino)-3-oxopropanoic acid
CAS Number:
95262-10-5
Molecular Formula:
C9H8FNO3
Molecular Weight:
197.1631
MDL Number:
MFCD00201972
IUPAC Name:
3-(4-fluoroanilino)-3-oxopropanoic acid
InChI:
InChI=1S/C9H8FNO3/c10-6-1-3-7(4-2-6)11-8(12)5-9(13)14/h1-4H,5H2,(H,11,12)(H,13,14)
InChI Key:
ISLQUPSDLYAGBQ-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)F)CC(=O)O
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.049g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.165g/mol
Monoisotopic Mass:
197.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties