4-Hydroxy-3,5-diiodobenzoic acid

Basic Information

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CAS Number

618-76-8

Molecular Formula

C7H4I2O3

Molecular Weight

389.91 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

262 ºC

Boiling Point

346.4°C at 760 mmHg

Density

2.697±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

163.3°C

Refractive Index

1.784

SMILES

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C1=C(C=C(C(=C1I)O)I)C(=O)O

InChI

InChI=1S/C7H4I2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)

InChIKey

XREKTVACBXQCSB-UHFFFAOYSA-N

LogP

2.2996

Topological Polar Surface Area

57.53 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

174

Safety Information

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Sensitiveness

Light Sensitive

Synonyms & References

English

A868608
Ioxynil acid
M and B 10903
XREKTVACBXQCSB-UHFFFAOYSA-N
AI3-14923
Q27270166
DTXSID1060685
CS-W011729
NSC-1497
3,5-Diiodo-4-hydroxybenzoic acid
4-Hydroxy-3,5-diiodobenzoic acid
8C0QV5JK0D
AJ-087/41885658
BRN 2212145
AKOS022171999
BDBM50145835
CHEMBL83650
SCHEMBL1613916
FT-0614624
M&B-10903
MFCD00016532
SY316290
UNII-8C0QV5JK0D
BENZOIC ACID, 3,5-DIIODO-4-HYDROXY-
MB-10903
3,5-Diiodo-4-hydroxy-benzoic acid
4-Hydroxy-3,5-diiodo-benzoic acid
EINECS 210-562-0
Ioxynil metabolite
Ioxynic acid
Benzoic acid, 4-hydroxy-3,5-diiodo-

MDL Number

MFCD00016532

Customs Code

2918290000

FAQ

What is 4-Hydroxy-3,5-diiodobenzoic acid (CAS: 618-76-8)?

4-Hydroxy-3,5-diiodobenzoic acid is a chemical compound with the CAS number 618-76-8. It is an organic acid with a molecular formula of C7H3IO4. This compound is characterized by its hydroxy and diiodo functionalities.

What are the main uses of 4-Hydroxy-3,5-diiodobenzoic acid (CAS: 618-76-8)?

4-Hydroxy-3,5-diiodobenzoic acid is primarily used in pharmaceuticals as an intermediate in the synthesis of other compounds. It also finds applications in research, particularly in the field of organic chemistry and medicinal chemistry.

Is 4-Hydroxy-3,5-diiodobenzoic acid (CAS: 618-76-8) safe?

4-Hydroxy-3,5-diiodobenzoic acid is generally considered safe when handled with appropriate precautions. However, it should be stored away from heat and direct sunlight. Protective gloves and goggles should be worn during handling to prevent skin and eye contact.

How should 4-Hydroxy-3,5-diiodobenzoic acid (CAS: 618-76-8) be stored?

4-Hydroxy-3,5-diiodobenzoic acid should be stored in a cool, dry place, away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation. Proper ventilation is recommended to avoid inhalation of fumes or dust.