Home Halogens 3-(2-chloro-6-fluorophenoxy)propanoic acid

3-(2-chloro-6-fluorophenoxy)propanoic acid

CAS No.:
1552688-63-7
Catalog Number:
AG01DVMX
Molecular Formula:
C9H8ClFO3
Molecular Weight:
218.6094
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Product Description
Catalog Number:
AG01DVMX
Chemical Name:
3-(2-chloro-6-fluorophenoxy)propanoic acid
CAS Number:
1552688-63-7
Molecular Formula:
C9H8ClFO3
Molecular Weight:
218.6094
MDL Number:
MFCD24362467
IUPAC Name:
3-(2-chloro-6-fluorophenoxy)propanoic acid
InChI:
InChI=1S/C9H8ClFO3/c10-6-2-1-3-7(11)9(6)14-5-4-8(12)13/h1-3H,4-5H2,(H,12,13)
InChI Key:
PLPOCQPLQSHUBI-UHFFFAOYSA-N
SMILES:
OC(=O)CCOc1c(F)cccc1Cl
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.608g/mol
Monoisotopic Mass:
218.015g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties