Home Other Building Blocks 2-Hydroxy-3-(trifluoromethoxy)benzoic acid

2-Hydroxy-3-(trifluoromethoxy)benzoic acid

CAS No.:
773873-50-0
Catalog Number:
AG005BKG
Molecular Formula:
C8H5F3O4
Molecular Weight:
222.1181
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Product Description
Catalog Number:
AG005BKG
Chemical Name:
2-Hydroxy-3-(trifluoromethoxy)benzoic acid
CAS Number:
773873-50-0
Molecular Formula:
C8H5F3O4
Molecular Weight:
222.1181
MDL Number:
MFCD06203613
IUPAC Name:
2-hydroxy-3-(trifluoromethoxy)benzoic acid
InChI:
InChI=1S/C8H5F3O4/c9-8(10,11)15-5-3-1-2-4(6(5)12)7(13)14/h1-3,12H,(H,13,14)
InChI Key:
SDFAGXLFYRIEBD-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1O)OC(F)(F)F
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.014g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
222.119g/mol
Monoisotopic Mass:
222.014g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties