Home Nitros Benzenepropanoic acid, 4-fluoro-3-nitro-

Benzenepropanoic acid, 4-fluoro-3-nitro-

CAS No.:
160877-40-7
Catalog Number:
AG001VFK
Molecular Formula:
C9H8FNO4
Molecular Weight:
213.1625
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001VFK
Chemical Name:
Benzenepropanoic acid, 4-fluoro-3-nitro-
CAS Number:
160877-40-7
Molecular Formula:
C9H8FNO4
Molecular Weight:
213.1625
MDL Number:
MFCD25959676
IUPAC Name:
3-(4-fluoro-3-nitrophenyl)propanoic acid
InChI:
InChI=1S/C9H8FNO4/c10-7-3-1-6(2-4-9(12)13)5-8(7)11(14)15/h1,3,5H,2,4H2,(H,12,13)
InChI Key:
IHRNYARREWSFGQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(c(c1)[N+](=O)[O-])F
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.044g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.164g/mol
Monoisotopic Mass:
213.044g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties