Home Other Building Blocks 3,4-Difluorophenylacetic acid

3,4-Difluorophenylacetic acid

CAS No.:
658-93-5
Catalog Number:
AG0033IJ
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$88
- +
100g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG0033IJ
Chemical Name:
3,4-Difluorophenylacetic acid
CAS Number:
658-93-5
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
MDL Number:
MFCD00010002
IUPAC Name:
2-(3,4-difluorophenyl)acetic acid
InChI:
InChI=1S/C8H6F2O2/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
YCAKYFIYUHHCKW-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(c(c1)F)F
EC Number:
211-527-2
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.131g/mol
Monoisotopic Mass:
172.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties