Home Other Building Blocks 5-methoxy-2-(trifluoromethoxy)benzoic acid

5-methoxy-2-(trifluoromethoxy)benzoic acid

CAS No.:
433330-73-5
Catalog Number:
AG01AUMX
Molecular Formula:
C9H7F3O4
Molecular Weight:
236.1447
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AUMX
Chemical Name:
5-methoxy-2-(trifluoromethoxy)benzoic acid
CAS Number:
433330-73-5
Molecular Formula:
C9H7F3O4
Molecular Weight:
236.1447
MDL Number:
MFCD18398452
IUPAC Name:
5-methoxy-2-(trifluoromethoxy)benzoic acid
InChI:
InChI=1S/C9H7F3O4/c1-15-5-2-3-7(16-9(10,11)12)6(4-5)8(13)14/h2-4H,1H3,(H,13,14)
InChI Key:
DHAFHABDEMTSLQ-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)O)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:
236.03g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.146g/mol
Monoisotopic Mass:
236.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties