Home Other Building Blocks 2-(2-Nitro-4-trifluoromethylphenyl)acetic acid

2-(2-Nitro-4-trifluoromethylphenyl)acetic acid

CAS No.:
1735-91-7
Catalog Number:
AG001YZN
Molecular Formula:
C9H6F3NO4
Molecular Weight:
249.1434
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$22
- +
5g
98%
In Stock USA
United States
$62
- +
10g
98%
In Stock USA
United States
$88
- +
25g
98%
In Stock USA
United States
$163
- +
100g
98%
In Stock USA
United States
$519
- +
Product Description
Catalog Number:
AG001YZN
Chemical Name:
2-(2-Nitro-4-trifluoromethylphenyl)acetic acid
CAS Number:
1735-91-7
Molecular Formula:
C9H6F3NO4
Molecular Weight:
249.1434
MDL Number:
MFCD00091534
IUPAC Name:
2-[2-nitro-4-(trifluoromethyl)phenyl]acetic acid
InChI:
InChI=1S/C9H6F3NO4/c10-9(11,12)6-2-1-5(3-8(14)15)7(4-6)13(16)17/h1-2,4H,3H2,(H,14,15)
InChI Key:
DUDZAZPWJFTDPV-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1[N+](=O)[O-])C(F)(F)F
EC Number:
217-081-5
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.025g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.145g/mol
Monoisotopic Mass:
249.025g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties