Home Nitros 3-nitro-4-(trifluoromethoxy)benzoic acid

3-nitro-4-(trifluoromethoxy)benzoic acid

CAS No.:
784-77-0
Catalog Number:
AG003JSM
Molecular Formula:
C8H4F3NO5
Molecular Weight:
251.1163
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$15
- +
5g
98%
In Stock USA
United States
$54
- +
10g
98%
In Stock USA
United States
$100
- +
25g
98%
In Stock USA
United States
$182
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG003JSM
Chemical Name:
3-nitro-4-(trifluoromethoxy)benzoic acid
CAS Number:
784-77-0
Molecular Formula:
C8H4F3NO5
Molecular Weight:
251.1163
MDL Number:
MFCD13185757
IUPAC Name:
3-nitro-4-(trifluoromethoxy)benzoic acid
InChI:
InChI=1S/C8H4F3NO5/c9-8(10,11)17-6-2-1-4(7(13)14)3-5(6)12(15)16/h1-3H,(H,13,14)
InChI Key:
GDBCQTKUSLDFRP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1OC(F)(F)F)C(=O)O
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.004g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.117g/mol
Monoisotopic Mass:
251.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties