Home Other Building Blocks 2-(4-(1,1,1-trifluoropropan-2-yl)phenyl)acetic acid

2-(4-(1,1,1-trifluoropropan-2-yl)phenyl)acetic acid

CAS No.:
1896617-19-8
Catalog Number:
AG01DKGR
Molecular Formula:
C11H11F3O2
Molecular Weight:
232.1990
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$273
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Product Description
Catalog Number:
AG01DKGR
Chemical Name:
2-(4-(1,1,1-trifluoropropan-2-yl)phenyl)acetic acid
CAS Number:
1896617-19-8
Molecular Formula:
C11H11F3O2
Molecular Weight:
232.1990
IUPAC Name:
2-[4-(1,1,1-trifluoropropan-2-yl)phenyl]acetic acid
InChI:
InChI=1S/C11H11F3O2/c1-7(11(12,13)14)9-4-2-8(3-5-9)6-10(15)16/h2-5,7H,6H2,1H3,(H,15,16)
InChI Key:
HAEYUYHOBWCNFI-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1)C(C(F)(F)F)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.071g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.202g/mol
Monoisotopic Mass:
232.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties