Home Other Building Blocks 2,5-Difluoro-4-methylbenzoic acid

2,5-Difluoro-4-methylbenzoic acid

CAS No.:
103877-80-1
Catalog Number:
AG0038ZX
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$83
- +
10g
98%
In Stock USA
United States
$138
- +
25g
98%
In Stock USA
United States
$244
- +
100g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG0038ZX
Chemical Name:
2,5-Difluoro-4-methylbenzoic acid
CAS Number:
103877-80-1
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
MDL Number:
MFCD00078261
IUPAC Name:
2,5-difluoro-4-methylbenzoic acid
InChI:
InChI=1S/C8H6F2O2/c1-4-2-7(10)5(8(11)12)3-6(4)9/h2-3H,1H3,(H,11,12)
InChI Key:
PWWMQUUDAAWEBK-UHFFFAOYSA-N
SMILES:
Fc1cc(C(=O)O)c(cc1C)F
Properties
Complexity:
184  
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:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties