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Home Carboxys 2-fluorobenzene-1,3-dicarboxylic acid

2-fluorobenzene-1,3-dicarboxylic acid

CAS No.:
1583-65-9
Catalog Number:
AG001Q3R
Molecular Formula:
C8H5FO4
Molecular Weight:
184.1213
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$207
- +
5g
95%
In Stock USA
United States
$669
- +
10g
95%
In Stock USA
United States
$1144
- +
Product Description
Catalog Number:
AG001Q3R
Chemical Name:
2-fluorobenzene-1,3-dicarboxylic acid
CAS Number:
1583-65-9
Molecular Formula:
C8H5FO4
Molecular Weight:
184.1213
MDL Number:
MFCD00042505
IUPAC Name:
2-fluorobenzene-1,3-dicarboxylic acid
InChI:
InChI=1S/C8H5FO4/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI Key:
DWOLBEJAJWCIGK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1F)C(=O)O
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.017g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
184.122g/mol
Monoisotopic Mass:
184.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Cheminformatics-based drug design approach for identification of inhibitors targeting the characteristic residues of MMP-13 hemopexin domain. PloS one 20100101
Properties