Basic information
- CAS
132830-14-9- Standard SMILES
O=C([O-])C(NCCNC(C(=O)[O-])c1ccccc1[O-])c1ccccc1[O-].[68Ga+3]- InChIKey
REWBREMQKLJYIQ-ZQSXMSGHSA-J- Molecular formula
- C18H16GaN2O6-
- Average molar mass
- 424.3 g/mol
- Monoisotopic mass
- 424.02882
Overview
used in positron emission tomography
Names & identifiers
- Preferred name
- Gallium(68)-ethylenediamine-N,N'-bis(2-hydroxyphenylacetic acid)
- IUPAC
- 2-[2-[[carboxylato-(2-oxidophenyl)methyl]amino]ethylamino]-2-(2-oxidophenyl)acetate;gallium-68(3+)
- English name
- gallium(68)-ethylenediamine-N,N'-bis(2-hydroxyphenylacetic acid)
- Molecular formula
- C18H16GaN2O6-
- Molecular weight
- 425.04344
Names & synonyms
132830-14-9Gallium(68)-ethylenediamine-N,N'-bis(2-hydroxyphenylacetic acid)RefChem:142196Ga-Ehpg
Database identifiers
- CAS
132830-14-9- PubChem CID
- 196852
Properties
Computed structural properties
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- -1
- Complexity
- 422
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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