sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 2,2-Difluoro-1,3-benzodioxole-5-carboxylic acid

2,2-Difluoro-1,3-benzodioxole-5-carboxylic acid

CAS No.:
656-46-2
Catalog Number:
AG00EAG4
Molecular Formula:
C8H4F2O4
Molecular Weight:
202.1118
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$29
- +
5g
98%
In Stock USA
United States
$94
- +
10g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$300
- +
100g
98%
In Stock USA
United States
$794
- +
Product Description
Catalog Number:
AG00EAG4
Chemical Name:
2,2-Difluoro-1,3-benzodioxole-5-carboxylic acid
CAS Number:
656-46-2
Molecular Formula:
C8H4F2O4
Molecular Weight:
202.1118
MDL Number:
MFCD00792417
IUPAC Name:
2,2-difluoro-1,3-benzodioxole-5-carboxylic acid
InChI:
InChI=1S/C8H4F2O4/c9-8(10)13-5-2-1-4(7(11)12)3-6(5)14-8/h1-3H,(H,11,12)
InChI Key:
VJLDRFCNFNQTTH-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)OC(O2)(F)F
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.008g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.113g/mol
Monoisotopic Mass:
202.008g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties