Home Other Building Blocks 2-hydroxy-2-[3-(trifluoromethoxy)phenyl]acetic acid

2-hydroxy-2-[3-(trifluoromethoxy)phenyl]acetic acid

CAS No.:
1214378-55-8
Catalog Number:
AG01BFFS
Molecular Formula:
C9H7F3O4
Molecular Weight:
236.1447
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Product Description
Catalog Number:
AG01BFFS
Chemical Name:
2-hydroxy-2-[3-(trifluoromethoxy)phenyl]acetic acid
CAS Number:
1214378-55-8
Molecular Formula:
C9H7F3O4
Molecular Weight:
236.1447
MDL Number:
MFCD20868635
IUPAC Name:
2-hydroxy-2-[3-(trifluoromethoxy)phenyl]acetic acid
InChI:
InChI=1S/C9H7F3O4/c10-9(11,12)16-6-3-1-2-5(4-6)7(13)8(14)15/h1-4,7,13H,(H,14,15)
InChI Key:
CANNFMISEMEBIT-UHFFFAOYSA-N
SMILES:
OC(c1cccc(c1)OC(F)(F)F)C(=O)O
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.03g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.146g/mol
Monoisotopic Mass:
236.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties