rel-10-[(1R,2S)-2,3-Dihydroxy-1-(hydroxyMethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetic Acid
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Grundinformationen
- CAS
151852-61-8- Standard-SMILES
O=C(O)CN1CCN(CC(=O)O)CCN([C@H](CO)[C@H](O)CO)CCN(CC(=O)O)CC1- InChIKey
JZNZSKXIEDHOBD-HUUCEWRRSA-N- Summenformel
- C18H34N4O9
- Durchschnittliche Molmasse
- 450,48 g/mol
Namen und Bezeichner
- Bevorzugter Name
- rel-10-[(1R,2S)-2,3-Dihydroxy-1-(hydroxyMethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetic Acid
- Englischer Name
- rel-10-[(1R,2S)-2,3-Dihydroxy-1-(hydroxyMethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetic Acid
- Summenformel
- C18H34N4O9
- Molmasse
- 450.48
Namen und Synonyme
Gadobutrol Impurity 57GADOBUTROL intermediateVildagliptin Impurity 88Gadobenic acid EP impurity BGadobutrol (Free Form) (Calcobutrol (Free Form))Gadobutrol Impurity 65 (Gadobutrol EP Impurity B)rel-10-[(1R,2S)-2,3-Dihydroxy-1-(hydroxyMethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetirel-10-[(1R,2S)-2,3-Dihydroxy-1-(hydroxyMethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetic AcidButrol triammonia saltQ: What is Butrol triammonia salt Q: What is the CAS Number of Butrol triammonia salt1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic acid, 10-[(1R,2S)-2,3-dihydroxy-1-(hydroxymethyl)propyl]-, rel-
Datenbank-Bezeichner
- CAS
151852-61-8- PubChem CID
- 72058
- UNII
- SMG09YI7I8
- Nikkaji
- J911.130A
Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 220 °C · >220°C (subl.)
- Siedepunkt
- 738.461 · 738.461±60.00 °C(Press: 760.00 Torr)(predicted)
- Dichte
- 1.344 · 1.344±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- Refrigerator, under inert atmosphere
- Löslichkeit
- Methanol (Slightly), Water (Slightly)
- pka
- 1.833 · 1.833±0.10(predicted)
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
Chemie und Industrie
Anwendungen
Verwendenrel-10-[(1R,2S)-2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetic Acid is an intermediate in the synthesis of Calcobutrol (C145700), a new macrocyclic polyhydroxylated gadolinium chelate derivative which can be used as a contrast agent for Magnetic Resonance Imaging (MRI).
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