Home Other Building Blocks 2,6-Difluoro-3-methylphenylacetic acid

2,6-Difluoro-3-methylphenylacetic acid

CAS No.:
261943-97-9
Catalog Number:
AG002S5Y
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$105
- +
1g
1 week
United States
$170
- +
5g
1 week
United States
$434
- +
Product Description
Catalog Number:
AG002S5Y
Chemical Name:
2,6-Difluoro-3-methylphenylacetic acid
CAS Number:
261943-97-9
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
MDL Number:
MFCD01631338
IUPAC Name:
2-(2,6-difluoro-3-methylphenyl)acetic acid
InChI:
InChI=1S/C9H8F2O2/c1-5-2-3-7(10)6(9(5)11)4-8(12)13/h2-3H,4H2,1H3,(H,12,13)
InChI Key:
XMNMLOQKAUVILT-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(F)ccc(c1F)C
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.049g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.158g/mol
Monoisotopic Mass:
186.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties