요오딕사놀

요오딕사놀 · OptiPrep · Visipaque · Iothalamate · DU-6807 · Ioxanol · Ioxaxol · odixanol

식별자 및 물리적 특성

CAS No.	92339-11-2
분자식	C35H44I6N6O15
평균 분자량	1,550.2 g/mol
단동위원소 질량	1,549.71330271 g/mol
SMILES	CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I
InChIKey	NBQNWMBBSKPBAY-UHFFFAOYSA-N
PubChem CID	3724
ChEMBL	CHEMBL1200507
ChEBI	CHEBI:31705
EC No.	618-837-0
DTXSID	DTXSID2045523
현지명	요오딕사놀

화학 및 물리적 성질

XLogP	-3.4
극성 표면적	339
수소 결합 공여자 수	13
수소 결합 수용자 수	15
회전 가능 결합 수	22
무거운 원자 수	62
형식 전하	0
복잡도	1,330
의약품	Pharmaceuticals
pH	7.2-7.6 (c = 320 mg I/L)
LogP(분배 계수)	0.5
밀도	1.2661.266 ±0.003
Viscosity	11.1 mPa at 37 °C
용해도	Soluble in water1.85e-01 g/L물에 잘 녹고, 메탄올에 조금 녹고, 염화메틸렌에는 거의 녹지 않습니다.
Human Drugs	Breast FeedingLactationMilk, HumanContrast MediaDiagnostic AgentsFDA approved drugs -> Active ingredient
녹는점	240-250 °C262-267°C (dec.)
Physical Description	Solid
Other Experimental Properties	Osmolality 290 mOsm/kg H2O
끓는 점	1250.9±65.0 °C(Predicted)
증기압	0Pa at 20℃
굴절률	n 1.4128 ±0.0003
저장 조건	Refrigerator
pKa(산도 계수)	11.04±0.46(Predicted)
물리적 상태	liquid
색상	하얀색
주요 응용	의약품(소분자)
InChIKey	NBQNWMBBSKPBAY-UHFFFAOYSA-N
SMILES	C(N(C1C(I)=C(C(NCC(O)CO)=O)C(I)=C(C(NCC(O)CO)=O)C=1I)C(C)=O)C(O)CN(C1C(I)=C(C(NCC(O)CO)=O)C(I)=C(C(NCC(O)CO)=O)C=1I)C(C)=O
LogP(분배 계수)	0.7
EPA	1,3-Benzenedicarboxamide, 5,5'-[(2-hydroxy-1,3-propanediyl)bis(acetylimino)]bis[N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo- (92339-11-2)

화학적 성질

White Solid

안전 및 규제

GHS 분류	Not Classified
규제 정보	Status: Active Update: 19-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/7066
FDA 요건	The Approved Drug Products with Therapeutic Equivalence Evaluations identifies currently marketed prescription drug products, including iodixanol, approved on the basis of safety and effectiveness by FDA under sections 505 of the Federal Food, Drug, and Cosmetic Act.
Hazard Classes and Categories	Not Classified
Hazardous Reactivities and Incompatibilities	/Investigators sought/ to test the compatibility of trisodium citrate, a catheter lock solution, with iodinated contrast medium. ...Ioxaglate... was tested. In all tests, 2 mL of contrast medium were mixed with 2 mL of trisodium citrate solution. ...Ioxaglate provoked a highly viscous gluelike precipitation when mixed with trisodium citrate. /It was concluded that/one must be aware of the potential for precipitation when contrast medium is mixed with trisodium citrate solution. Before trisodium citrate solution is injected, the catheter should be thoroughly flushed with saline if a contrast medium has previously been injected through it.
소화 절차	As with all fires, evacuate personnel to a safe area. Firefighters should use self-contained breathing equipment and protective clothing.Water spray, dry chemical, carbon dioxide, or foam as appropriate for surrounding fire and materials.
보관 조건	Store in tight container ... . This material should be handled and stored per label instructions to ensure product integrity.
정리 방법	Wear approved respiratory protection, chemically compatible gloves, and protective clothing. Wipe up spillage or collect spillage using a high-efficiency vacuum cleaner. Avoid breathing dust. Place spillage in appropriately labeled container for disposal. Wash spill site.
처리 방법	SRP: Expired or waste pharmaceuticals shall carefully take into consideration applicable DEA, EPA, and FDA regulations. It is not appropriate to dispose by flushing the pharmaceutical down the toilet or discarding to trash. If possible return the pharmaceutical to the manufacturer for proper disposal being careful to properly label and securely package the material. Alternatively, the waste pharmaceutical shall be labeled, securely packaged and transported by a state licensed medical waste contractor to dispose by burial in a licensed hazardous or toxic waste landfill or incinerator.

용도

Nonionic, dimeric x-ray contrast medium. Diagnostic aid (radiopaque medium).

일반 설명

Iodixanol is a viscous, isosmolar,nonionic, water-soluble dimer with 49% iodine content.It is formulated as an isotonic solution for intravascular injectionand indicated for excretory urography, angiography,and CT procedures.