Home Halogens 3-(2-chloro-6-fluorophenyl)-2-hydroxypropanoic acid

3-(2-chloro-6-fluorophenyl)-2-hydroxypropanoic acid

CAS No.:
1181561-52-3
Catalog Number:
AG01AD51
Molecular Formula:
C9H8ClFO3
Molecular Weight:
218.6094
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Product Description
Catalog Number:
AG01AD51
Chemical Name:
3-(2-chloro-6-fluorophenyl)-2-hydroxypropanoic acid
CAS Number:
1181561-52-3
Molecular Formula:
C9H8ClFO3
Molecular Weight:
218.6094
MDL Number:
MFCD11937153
IUPAC Name:
3-(2-chloro-6-fluorophenyl)-2-hydroxypropanoic acid
InChI:
InChI=1S/C9H8ClFO3/c10-6-2-1-3-7(11)5(6)4-8(12)9(13)14/h1-3,8,12H,4H2,(H,13,14)
InChI Key:
ZNDHYXRNPRMLHH-UHFFFAOYSA-N
SMILES:
OC(C(=O)O)Cc1c(F)cccc1Cl
Properties
Complexity:
212  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
218.608g/mol
Monoisotopic Mass:
218.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties