Iopanoic Acid

Basic Information

View in Editor

CAS Number

96-83-3

Molecular Formula

C11H12I3NO2

Molecular Weight

570.93 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

150.0 to 156.0 deg-C

Boiling Point

529.1°C at 760 mmHg

Density

2.2567 (estimate)

SMILES

View in Editor

CCC(CC1=C(C(=C(C=C1I)I)N)I)C(=O)O

InChI

InChI=1S/C11H12I3NO2/c1-2-5(11(16)17)3-6-7(12)4-8(13)10(15)9(6)14/h4-5H,2-3,15H2,1H3,(H,16,17)

InChIKey

OIRFJRBSRORBCM-UHFFFAOYSA-N

LogP

3.7359000000000018

pKa

4.8(at 25℃)

Topological Polar Surface Area

63.32000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

277

Safety Information

View Safety Information

GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

2-(3-Amino-2,4,6-triiodobenzyl)butanoic acid
2-(3-amino-2,4,6-triiodobenzyl)butyric acid
Iodopanoicacid
Iopanoic Acid
2-[(3-amino-2,4,6-triiodophenyl)methyl]butanoic acid
Bilijodon
Choladine
Cholevid
Iopagnost
Jopanoic acid
Polognost
Telepaque
3-(3-Amino-2,4,6-triiodophenyl)-2-ethylpropanoic acid
3-Amino-α-ethyl-2,4,6-triiodohydrocinnamic Acid
3-(3-Amino-2,4,6-triiodophenyl)-2-ethylpropionic Acid
2-Ethyl-3-(3-amino-2,4,6-triiodophenyl)propionic acid
Iodopanoic acid
Iopanoicum
iopanic acid
Copanoic
Colepax
Cistobil
Jopagnost
Teletrast
Acidum iopanoicum
Iodopanic acid
Acide iopanoique [French]
Acidum iopanoicum [INN-Latin]
Acido iopanoico [INN-Spanish]
Acide iopanoique [INN-French]
Acido iopanoico [Latin,Spanish]

MDL Number

MFCD00038687

Customs Code

2922499990

FAQ

What is Iopanoic Acid (CAS: 96-83-3)?

Iopanoic acid (CAS: 96-83-3) is a sulfuric acid ester used as a diagnostic aid in the excretory urography process. It is a white crystalline powder with a molecular formula of C9H9NO4S.

What are the main uses of Iopanoic Acid (CAS: 96-83-3)?

Iopanoic acid is primarily used as a contrast agent in medical imaging, aiding in the visualization of the urinary tract. It is also used in research for chemical and biological studies.

Is Iopanoic Acid (CAS: 96-83-3) safe?

Iopanoic acid (CAS: 96-83-3) is generally considered safe when used as directed under medical supervision. However, it can cause allergic reactions and should be handled with care to avoid skin and eye contact. Protective measures such as gloves and goggles are recommended.

How should Iopanoic Acid (CAS: 96-83-3) be stored?

Iopanoic acid (CAS: 96-83-3) 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 moisture and contamination. Avoid storing it near incompatible materials such as strong acids or bases.