Home Iodos 618-76-8
618-76-8,MFCD00016532
Catalog No.:AA003IKR
618-76-8 | 3,5-Diiodo-4-hydroxybenzoic acid
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1g
98%(HPLC)
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$45.00   $32.00
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5g
98%(HPLC)
in stock  
$108.00   $76.00
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10g
98%(HPLC)
in stock  
$143.00   $100.00
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25g
98%(HPLC)
in stock  
$264.00   $185.00
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100g
98%(HPLC)
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IKR
Chemical Name:
3,5-Diiodo-4-hydroxybenzoic acid
CAS Number:
618-76-8
Molecular Formula:
C7H4I2O3
Molecular Weight:
389.9138
MDL Number:
MFCD00016532
IUPAC Name:
4-hydroxy-3,5-diiodobenzoic acid
InChI:
InChI=1S/C7H4I2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)
InChI Key:
XREKTVACBXQCSB-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(I)c(c(c1)I)O
EC Number:
210-562-0
UNII:
8C0QV5JK0D
NSC Number:
1497
Properties
Computed Properties
 
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.825g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
389.915g/mol
Monoisotopic Mass:
389.825g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
4-Hydroxy-3,5-diiodobenzoic acid 
3,5-Diiodo-4-hydroxybenzoic acid 
MFCD00016532 
BRN 2212145 
8C0QV5JK0D 
CHEMBL83650 
AI3-14923 
Ioxynic acid 
BENZOIC ACID, 3,5-DIIODO-4-HYDROXY- 
AJ-087/41885658 
AC1L1YRL 
ACMC-1B674 
618-76-8 
SCHEMBL1613916 
DTXSID1060685 
CTK5B3949 
NSC1497 
XREKTVACBXQCSB-UHFFFAOYSA-N 
NSC-1497 
ZINC4099416 
3,5-Diiodo-4-hydroxy-benzoic acid 
7825AF 
BDBM50145835 
Ioxynil acid 
Benzoic acid,4-hydroxy-3,5-diiodo- 
AKOS022171999 
AN-3688 
MCULE-5998143444 
TRA0081736 
AJ-48040 
AK139954 
AS-10550 
LS-37096 
SC-53856 
Benzoic acid, 4-hydroxy-3,5-diiodo- 
3,5-DIIODO-4-HYDROXY BENZOIC ACID 
AX8082698 
TC-169937 
FT-0614624 
ST24043781 
ST50984576 
C-57429 
I14-90637 
Benzoic acid,5-diiodo- 
C7H4I2O3 
UNII-8C0QV5JK0D 
C7-H4-I2-O3 
CID12065 
3,5-DIIODO-4-HYDROXYBENZOICACID 
4-10-00-00479 (Beilstein Handbook Reference) 
M and B 10903 
NSC 1497 
4-Hydroxy-3,5-diiodo-benzoic acid 
EINECS 210-562-0 
Literature

Title: Hydrolysis of benzonitrile herbicides by soil actinobacteria and metabolite toxicity.

Journal: Biodegradation 20100901

Title: Non-peptidic small-molecule inhibitors of the single-chain hepatitis C virus NS3 protease/NS4A cofactor complex discovered by structure-based NMR screening.

Journal: Journal of medicinal chemistry 20040506

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