GADOBENATE DIMEGLUMINE structure, CAS 127000-20-8

GADOBENATE DIMEGLUMINE

CAS Number127000-20-8

SynonymsGadobenic acid dimeglumine salt; Multihance Multipack; Gd-Bopta/dimeg; UNII-3Q6PPC19PO

Molecular FormulaC36H62GdN5O21

Molecular Weight1058.15000

Purity

Density

Boiling Point794.9ºC at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

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Symbol

Signal Word

Cat. No.: 2A-2198293 Purity:
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Quality Control of [ 127000-20-8 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number127000-20-8
Catalog No.2A-2198293
Chinese Name钆贝葡胺
SynonymsGadobenic acid dimeglumine salt; Multihance Multipack; Gd-Bopta/dimeg; UNII-3Q6PPC19PO
Molecular FormulaC36H62GdN5O21
Molecular Weight1058.15000
Boiling Point794.9ºC at 760 mmHg
SMILESCNCC(O)C(O)C(O)C(O)CO.CNCC(O)C(O)C(O)C(O)CO.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)C(COCc1ccccc1)C(=O)O.[Gd]
InChIInChI=1S/C22H31N3O11.2C7H17NO5.Gd/c26-18(27)10-23(6-7-24(11-19(28)29)12-20(30)31)8-9-25(13-21(32)33)17(22(34)35)15-36-14-16-4-2-1-3-5-16;2*1-8-2-4(10)6(12)7(13)5(11)3-9;/h1-5,17H,6-15H2,(H,26,27)(H,28,29)(H,30,31)(H,32,33)(H,34,35);2*4-13H,2-3H2,1H3;/q;;;+3/p-3/t;2*4-,5+,6+,7+;/m.00./s1
InChI KeyWYXRLXLMVFQPOH-UHFFFAOYSA-N
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