Home Halogens Benzenepropanoic acid, 4-chloro-2-fluoro-

Benzenepropanoic acid, 4-chloro-2-fluoro-

CAS No.:
174603-48-6
Catalog Number:
AG001ZSR
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
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Product Description
Catalog Number:
AG001ZSR
Chemical Name:
Benzenepropanoic acid, 4-chloro-2-fluoro-
CAS Number:
174603-48-6
Molecular Formula:
C9H8ClFO2
Molecular Weight:
202.6100
MDL Number:
MFCD06656906
IUPAC Name:
3-(4-chloro-2-fluorophenyl)propanoic acid
InChI:
InChI=1S/C9H8ClFO2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)
InChI Key:
BPNDGBIQQXCTBI-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(cc1F)Cl
Properties
Complexity:
187  
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:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties