3-Hydroxy-4-iodobenzoic acid

Basic Information

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CAS Number

58123-77-6

Molecular Formula

C7H5IO3

Molecular Weight

264.02 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

225.0 to 233.0 deg-C

Boiling Point

319.8°C at 760 mmHg

Density

2.155

Flash Point

147.2°C

Refractive Index

1.712

SMILES

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C1=CC(=C(C=C1C(=O)O)O)I

InChI

InChI=1S/C7H5IO3/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,9H,(H,10,11)

InChIKey

UABBBWVTEWIIMN-UHFFFAOYSA-N

LogP

1.6949999999999998

Topological Polar Surface Area

57.53 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

160

Safety Information

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GHS Hazard Pictograms

H301

H315

H318

H335

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H318 Causes serious eye damage
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 6.1 Class 6.1

Sensitiveness

Light Sensitive

Synonyms & References

English

SY041688
3-Hydroxy-4-iodo-benzoic acid
H1496
CS-W008049
AKOS007930832
MFCD02068386
4-Iodo-3-hydroxybenzoic acid
58123-77-6
3-Hydroxy-4-iodobenzoic acid, 97%
4-Iodo-3-hydroxy-benzoic acid
UABBBWVTEWIIMN-UHFFFAOYSA-N
C7H5IO3
AM20040772
AC-5637
3-Hydroxy-4-iodobenzoicacid
AB10648
FT-0615820
Benzoic acid, 3-hydroxy-4-iodo-
SCHEMBL351139
EN300-116482
3-Hydroxy-4-iodobenzoic acid
DTXSID60353120
GS-0934
J-512635
Z1269202149
BCP09356
3-Hydroxy-4-jod-benzoesaeure
4-iodo-3-hydroxy-benzoic acid
METHYL-4-IODO-3-HYDROXY BENZOATE
KSC497O7H
STL555597

MDL Number

MFCD02068386

Customs Code

2918290000

FAQ

What are the physical and chemical properties of 3-Hydroxy-4-iodobenzoic acid (CAS: 58123-77-6)?

3-Hydroxy-4-iodobenzoic acid is a crystalline solid with a molecular weight of approximately 255.01 g/mol. It has a solubility of about 1.5 g/L in water at 25°C. The compound is relatively stable under normal conditions but can react with bases to form sodium salts. It is also prone to hydrolysis under acidic conditions.

How is 3-Hydroxy-4-iodobenzoic acid (CAS: 58123-77-6) typically synthesized?

3-Hydroxy-4-iodobenzoic acid is typically synthesized via the iodination of 3-hydroxybenzoic acid. This process often involves using N-iodosuccinimide (NIS) as the iodinating agent in the presence of a base such as sodium hydroxide. The reaction is carried out in an aqueous medium, and the yield can be improved by using appropriate conditions and solvents.

What industries use 3-Hydroxy-4-iodobenzoic acid (CAS: 58123-77-6)?

3-Hydroxy-4-iodobenzoic acid is used in various industries. It is particularly relevant in the pharmaceutical industry for the synthesis of certain drugs. Additionally, it can be used in the production of sensors and as a raw material in the polymer industry for the development of novel materials with specific properties.

What precautions should be taken when handling 3-Hydroxy-4-iodobenzoic acid (CAS: 58123-77-6)?

When handling 3-Hydroxy-4-iodobenzoic acid, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be stored in a cool, well-ventilated area away from direct sunlight. Fume hoods should be used when performing synthesis or handling the compound. In case of a spill, it should be immediately cleaned up using appropriate chemicals and methods. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.