Home Other Building Blocks 2-Methoxy-5-(trifluoromethyl)benzoic acid

2-Methoxy-5-(trifluoromethyl)benzoic acid

CAS No.:
4864-01-1
Catalog Number:
AG003HJ5
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$38
- +
5g
97%
In Stock USA
United States
$113
- +
10g
97%
In Stock USA
United States
$200
- +
25g
97%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG003HJ5
Chemical Name:
2-Methoxy-5-(trifluoromethyl)benzoic acid
CAS Number:
4864-01-1
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
MDL Number:
MFCD01862091
IUPAC Name:
2-methoxy-5-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C9H7F3O3/c1-15-7-3-2-5(9(10,11)12)4-6(7)8(13)14/h2-4H,1H3,(H,13,14)
InChI Key:
NAKZCKOHULJEID-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)O)C(F)(F)F
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.147g/mol
Monoisotopic Mass:
220.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties