Home Other Building Blocks 2-(2-fluoro-6-(trifluoromethoxy)phenyl)acetic acid

2-(2-fluoro-6-(trifluoromethoxy)phenyl)acetic acid

CAS No.:
1806431-69-5
Catalog Number:
AG01DYZR
Molecular Formula:
C9H6F4O3
Molecular Weight:
238.1358
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Product Description
Catalog Number:
AG01DYZR
Chemical Name:
2-(2-fluoro-6-(trifluoromethoxy)phenyl)acetic acid
CAS Number:
1806431-69-5
Molecular Formula:
C9H6F4O3
Molecular Weight:
238.1358
MDL Number:
MFCD28798861
IUPAC Name:
2-[2-fluoro-6-(trifluoromethoxy)phenyl]acetic acid
InChI:
InChI=1S/C9H6F4O3/c10-6-2-1-3-7(16-9(11,12)13)5(6)4-8(14)15/h1-3H,4H2,(H,14,15)
InChI Key:
HXFHDVRURMWZGJ-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(cccc1F)OC(F)(F)F
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.025g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.138g/mol
Monoisotopic Mass:
238.025g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties