ChemicalBook--->CAS DataBase List--->3119-15-1

3119-15-1

3119-15-1 Structure

3119-15-1 Structure
IdentificationMore
[Name]

3-Amino-2,4,6-triiodobenzoic acid
[CAS]

3119-15-1
[Synonyms]

2,4,6-TRIIODO-3-AMINOBENZOIC ACID
3-AMINO-2,4,6-TRIIODOBENZOIC ACID
3-amino-2,4,6-triiodo-benzoicaci
acido3-amino-2,4,6-triiodobenzoico
3-Amino-2,4,6-triiodobenzoic acid, 99% (dry wt.), may cont. up to 1 mole of water
Benzoic acid, 3-amino-2,4,6-triiodo-
3-AMINO-2,4,6-TRIIODOBENZOIC ACID, 99+%
[EINECS(EC#)]

221-493-0
[Molecular Formula]

C7H4I3NO2
[MDL Number]

MFCD00007681
[Molecular Weight]

514.83
[MOL File]

3119-15-1.mol
Chemical PropertiesBack Directory
[Appearance]

Light yellow to tan powder
[Melting point ]

196-199 °C
[Boiling point ]

478.9±45.0 °C(Predicted)
[density ]

2.7479 (estimate)
[vapor pressure ]

0.001Pa at 25℃
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[pka]

1.50±0.10(Predicted)
[color ]

Crystals
[Water Solubility ]

Insoluble in water.
[Major Application]

pharmaceutical (small molecule)
[InChI]

1S/C7H4I3NO2/c8-2-1-3(9)6(11)5(10)4(2)7(12)13/h1H,11H2,(H,12,13)
[InChIKey]

QMQFFHSJUJDRPG-UHFFFAOYSA-N
[SMILES]

Nc1c(I)cc(I)c(C(O)=O)c1I
[LogP]

-1.43-3.31 at 25℃ and pH1-9
[Dissociation constant]

2.7-2.9
[CAS DataBase Reference]

3119-15-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

WGK 3
[RTECS ]

DG3349000
[REACH Registrations]

Active
[HazardClass ]

IRRITANT
[HS Code ]

2922493800
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
[Toxicity]

LD50 unr-rat: 1450 mg/kg JAPMA8 42,721,53
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Water-->Sodium metabisulfite-->3-Aminobenzoic acid-->Iodine monochloride-->Iodine chloride solution (Wijs' chloride)-->2,3,5-Triiodobenzoic acid-->Acetrizoic acid-->Iodic acid-->Iodine
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Amino-2,4,6-triiodobenzoic acid(3119-15-1).msds
Hazard InformationBack Directory
[Chemical Properties]

Light yellow to tan powder
[Uses]

3-Amino-2,4,6-triiodobenzoic Acid is used to prepare polymeric hydrogel based particles used in vascular embolization.
[Uses]

3-Amino-2,4,6-triiodobenzoic acid is used to prepare polymeric hydrogel based particles used in vascular embolization. It can be used in agrochemical, pharmaceutical and dyestuff field.
[Safety Profile]

Moderately toxic by ingestion andother routes. When heated to decomposition it emits toxicfumes of I- and NOx.
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

3-Amino-2,4,6-triiodobenzoic acid, 99% (dry wt.), may cont. up to 1 mole of water(3119-15-1)
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