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Home Other Building Blocks 4-(Trifluoromethyl)phenylacetic acid

4-(Trifluoromethyl)phenylacetic acid

CAS No.:
32857-62-8
Catalog Number:
AG0033UB
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$15
- +
25g
98%
In Stock USA
United States
$50
- +
100g
98%
In Stock USA
United States
$175
- +
500g
98%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG0033UB
Chemical Name:
4-(Trifluoromethyl)phenylacetic acid
CAS Number:
32857-62-8
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
MDL Number:
MFCD00004352
IUPAC Name:
2-[4-(trifluoromethyl)phenyl]acetic acid
InChI:
InChI=1S/C9H7F3O2/c10-9(11,12)7-3-1-6(2-4-7)5-8(13)14/h1-4H,5H2,(H,13,14)
InChI Key:
HNORVZDAANCHAY-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1)C(F)(F)F
EC Number:
251-263-5
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.148g/mol
Monoisotopic Mass:
204.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties