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Name	Ioxaglic acid	EINECS	N/A
CAS No.	59017-64-0	Density	2.545g/cm³
PSA	194.24000	LogP	4.69100
Solubility	N/A	Melting Point	302°C
Formula	C₂₄H₂₁I₆N₅O₈	Boiling Point	887.9°C at 760 mmHg
Molecular Weight	1268.90	Flash Point	490.8°C
Transport Information	N/A	Appearance	N/A
Safety	Mildly toxic by intravenous route. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of I⁻, Na₂O, and NO_x. An herbicide.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	3-[[2-[[3-[acetyl(methyl)amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]acetyl]amino]-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid;Ioxaglic acid;

Ioxaglic acid Chemical Properties

Empirical Formula of Ioxaglic acid (CAS NO.59017-64-0): C₂₄H₂₁I₆N₅O₈
Molecular Weight: 1268.8791 g/mol
Index of Refraction: 1.786
Density: 2.545 g/cm³
Flash Point: 490.8 °C
Enthalpy of Vaporization: 135.2 kJ/mol
Boiling Point: 887.9 °C at 760 mmHg
Vapour Pressure: 8.09E-34 mmHg at 25 °C
Structure of Ioxaglic acid (CAS NO.59017-64-0):

IUPAC Name: 3-[[2-[[3-[Acetyl(methyl)amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]acetyl]amino]-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid
Canonical SMILES: CC(=O)N(C)C1=C(C(=C(C(=C1I)C(=O)NCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)
NCCO)I)I)C(=O)NC)I
InChI: InChI=1S/C24H21I6N5O8/c1-7(37)35(3)20-17(29)10(21(39)31-2)13(25)11(18(20)30)23(41)33-6-8(38)34-19-15(27)9(22(40)32-4-5-36)14(26)12(16(19)28)24(42)43/h36H,4-6H2,1-3H3,(H,31,39)(H,32,40)(H,33,41)(H,34,38)(H,42,43)
InChIKey: TYYBFXNZMFNZJT-UHFFFAOYSA-N

Ioxaglic acid Uses

Ioxaglic acid (CAS NO.59017-64-0) is a molecule used as a contrast medium.

Ioxaglic acid Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
dog	LD50	intravenous	> 10700mg/kg (10700mg/kg)		Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 18, Pg. 474, 1987.
mouse	LD50	intraperitoneal	> 37300mg/kg (37300mg/kg)		Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 18, Pg. 474, 1987.
mouse	LD50	intravenous	> 13300mg/kg (13300mg/kg)	SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION	Kiso to Rinsho. Clinical Report. Vol. 19, Pg. 2411, 1985.
rabbit	LD50	intravenous	> 10700mg/kg (10700mg/kg)		Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 18, Pg. 474, 1987.
rat	LD50	intracrebral	102mg/kg (102mg/kg)		Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 18, Pg. 474, 1987.
rat	LD50	intravenous	13300mg/kg (13300mg/kg)	SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION	Kiso to Rinsho. Clinical Report. Vol. 19, Pg. 2411, 1985.
rat	LD50	oral	13300mg/kg (13300mg/kg)		Drugs in Japan Vol. -, Pg. 99, 1990.

Ioxaglic acid Safety Profile

Mildly toxic by intravenous route. Experimental reproductive effects. When heated to decomposition emits toxic fumes of I⁻, Na₂O, and NO_x. An herbicide.

Ioxaglic acid Specification

Ioxaglic acid , its cas register number is 59017-64-0. It also can be called Ioxaglate ; Benzoic acid, 3-((((3-(acetylmethylamino)-2,4,6-triiodo-5-((methylamino)carbonyl)benzoyl)amino)acetyl)amino)-5-(((2-hydroxyethyl)amino)carbonyl)-2,4,6-triiodo- ; and N-(2-Hydroxyethyl)-2,4,6-triiodo-5-(2-(2,4,6-triiodo-3-(N-methylacetamido)-5-(methylcarbamoyl)benzamido)acetamido)isophthalamic acid .

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