Home Halogens 2-(3-chloro-4-fluorophenyl)propanoic acid

2-(3-chloro-4-fluorophenyl)propanoic acid

CAS No.:
1368552-34-4
Catalog Number:
AG01DVY3
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
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Product Description
Catalog Number:
AG01DVY3
Chemical Name:
2-(3-chloro-4-fluorophenyl)propanoic acid
CAS Number:
1368552-34-4
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
MDL Number:
MFCD21985769
IUPAC Name:
2-(3-chloro-4-fluorophenyl)propanoic acid
InChI:
InChI=1S/C9H8ClFO2/c1-5(9(12)13)6-2-3-8(11)7(10)4-6/h2-5H,1H3,(H,12,13)
InChI Key:
WQCTVPRDXUKRPI-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(c(c1)Cl)F)C
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.02g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.609g/mol
Monoisotopic Mass:
202.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties