CAS
80526-44-9 Purity
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80526-44-9 Purity
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Gadopentetic acid
CAS
80529-93-7
Catalog Number
ACM80529937
Category
Other Products
Molecular Weight
547.57
Molecular Formula
C14H20GdN3O10
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Specification
Synonyms
gadoliniumdtpa;DIETHYLENETRIAMINEPENTAACETIC ACID, GADOLINIUM(III) DIHYDROGEN SALT HYDRATE;GADOPENTETIC ACID;GADOPENTETIC ACID HYDRATE;GADOLINIUM(II) DIETHYLENETRIAMINEPENTAACETIC ACID, HYDRATE;GADOPENTETATE;Gadopentetic;Diethylenetriaminepentaacetic ac
IUPAC Name
2-[bis[2-[bis(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate; gadolinium(3+); hydron
Canonical SMILES
C(CN(CC(=O)O)CC(=O)[O-])N(CCN(CC(=O)O)CC(=O)[O-])CC(=O)[O-].[Gd+3]
InChI Key
IZOOGPBRAOKZFK-UHFFFAOYSA-K
Boiling Point
721.1ºC at 760 mmHg
Melting Point
129ºC (dec.)(lit.)
Flash Point
389.9ºC
Density
g/cm³
Appearance
Powder
Exact Mass
548.03900
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
13
H-Bond Donor
0
Safety Description
26-37/39
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