Account 2,2',2''-(10-(1,3,4-Trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid
- Catalog No. :
- ACSTQX846
- CAS No. :
- 138168-36-2
- Molecular Formula :
- C18H34N4O9
- Molecular Weight :
- 450.49
IUPAC Name:2,2',2''-(10-(1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid
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Product Information
| Product Name | 2,2',2''-(10-(1,3,4-Trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid |
|---|---|
| IUPAC Name | 2,2',2''-(10-(1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid |
| Molecular Formula | C18H34N4O9 |
| Molecular Weight | 450.49 |
| SMILES | O=C(O)CN1CCN(CC(=O)O)CCN(CCN(CC(=O)O)CC1)C(CO)C(O)CO |
| InChI Key | JZNZSKXIEDHOBD-UHFFFAOYSA-N |
| Synonym | 1,4,7,10-TETRAAZACYCLODODECANE-1,4,7-TRIACETIC ACID,10-[2,3-DIHYDROXY-1-(HYDROXYMETHYL)PROPYL]-;10-(1-Hydroxymethyl-2,3-dihydroxypropyl)-1,4,7-triscarboxymethyl-1,4.7,10-tetraazacyclododecane;Gadobutrol EP Impurity BQ: What is Gadobutrol EP Impurity B Q: What is the CAS Number of Gadobutrol EP Impurity B;2,2,2-[10-[(1RS,2SR)-2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triyl]triacetic Acid;GDB2;Gadolinium cloth alcohol intermediateII |
| CAS No. | 138168-36-2 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACSTQX846 Molecular Building Block Synthetic Route
rel-Calcium 2,2'-(7-(carboxymethyl)-10-((2R,3S)-1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4-diyl)diacetate
rel-2,2',2''-(10-((2R,3S)-1,3,4-Trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid
2,2'-(4,10-Bis(1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,7-diyl)diacetic acid tetrahydrochloride