2,2',2''-[10-(羧甲基)-1,4,7,10-四氮杂环十二烷-1,4,7-三基]三乙酸钆 - 1-脱氧-1-(甲氨基)-D-山梨糖醇 (1:1)

Name: 2,2',2''-[10-(羧甲基)-1,4,7,10-四氮杂环十二烷-1,4,7-三基]三乙酸钆 - 1-脱氧-1-(甲氨基)-D-山梨糖醇 (1:1)
Brand: 济南圣和化工有限公司

CAS 120066-54-8C17H29GdN4O7MW 558.7

2,2',2''-[10-(羧甲基)-1,4,7,10-四氮杂环十二烷-1,4,7-三基]三乙酸钆 - 1-脱氧-1-(甲氨基)-D-山梨糖醇 (1:1)，CAS 登记号 120066-54-8，由济南圣和化工有限公司现货供应，可提供纯度按批次COA提供(不公开发布) 的规格，下游主要用于有机化学品。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。

规格参数

CAS号120066-54-8

分子式C17H29GdN4O7

分子量558.7

熔点>225 °C

纯度按批次COA提供(不公开发布)

包装按订单/批次确认(不公开发布)

应用领域有机化学品

类别有机化学品

用途与场景

有机化学品

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2,2',2''-[10-(羧甲基)-1,4,7,10-四氮杂环十二烷-1,4,7-三基]三乙酸钆 - 1-脱氧-1-(甲氨基)-D-山梨糖醇 (1:1) 一般用在什么产品里？

主要涉及有机化学品。

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PubChem 公开数据

Description

Gadoteridol · CAS 120066-54-8 · C17H29GdN4O7. UNII 0199MV609F. Melting Point: >225 °C; Solubility: In water, 737 mg/mL.

Identification

CAS Registry Number	120066-54-8
PubChem CID	60714
Molecular formula	C17H29GdN4O7
IUPAC name	2-[4,7-bis(carboxylatomethyl)-10-(2-hydroxypropyl)-1,4,7,10-tetrazacyclododec-1-yl]acetate;gadolinium(3+)
UNII (FDA)	0199MV609F

Computed Descriptors

Molecular Weight	558.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	5
Exact Mass	559.12774
Monoisotopic Mass	559.12774
Topological Polar Surface Area	154
Heavy Atom Count	29
Formal Charge	0
Complexity	471

Physical & Chemical Properties

Melting Point	>225 °C
Solubility	In water, 737 mg/mL

Physical description & handling notes

White solid obtained as an aggregate clump of fine needle-like micro-crystals from methanol/acetone
Solubility (mg/mL): methanol 119, isopropanol 41, dimethylformamide 10.1, acetonitrile 6.1, methylene chloride 5.2, ethyl acetate 0.5, acetone 0.4, hexane 0.2, toluene 0.3
Osmolality (37 °C): 630 mOsM/kg water; viscosity (cP): 2.0 (20 °C), 1.3 (37 °C); density at 25 °C 1.140. /Gadoteridol injection/
log Kow = -3.68 (octanol/water); logP = -1.98 (butanol/water), at pH 7
Hydrophilic
ProHance (Gadoteridol) Injection is a clear, colorless to slightly yellow solution containing 279.3 mg/mL of gadoteridol in rubber stoppered vials.

Documented Uses

Injectable contrast Medium for Magnetic Resonance Imaging (MRI)
Typical contrast agents are gadolinium-based compounds that possess a higher linear attenuation coefficient than soft tissues. /Contrast agents/
Use (kg; approx.) in Germany (2009): >500
Consumption (g per capita; approx.) in Germany (2009): 0.00611
Preparation: M. F. Tweedle et al, European Patent Office patent 292689; eidem, United States of America patent 4885363 (1988, 1989, both to Squibb).
Gadoteridol is indicated for use with magnetic resonance imaging (MRI) in order to visualize lesions with disrupted blood-brain barrier and/or abnormal vascularity in the brain, spine, and associated tissues in adult and pediatric patients, including term neonates. It is also indicated for visualization of lesions in the head and neck in adult patients.

Synonyms

GADOTERIDOL; ProHance; 120066-54-8; Gadolinium-HP-DO3A; Prohance Multipack; DTXSID2048662; GD-HP-DO 3A; SQ-32692; Gd-HPDO3A; Gd-HP-DO3A; Gadolinium-HP-Do 3A; DTXCID5028588; 0199MV609F; NSC-760055; HSDB 7549; SQ 32,692

Frequently Asked Questions

What are the CAS number and molecular formula of Gadoteridol?

CAS 120066-54-8; molecular formula C17H29GdN4O7; molecular weight — g/mol.

What other names is Gadoteridol known by?

GADOTERIDOL, ProHance, 120066-54-8, Gadolinium-HP-DO3A, Prohance Multipack, DTXSID2048662.

What are the key physical properties of Gadoteridol?

Melting Point: >225 °C; Solubility: In water, 737 mg/mL.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.

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