5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
CAS: 20315-46-2
Molecular Formula: C32H41N5O5
5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione - Names and Identifiers
| Name | 5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione |
| Synonyms | b-Ergocryptine beta-ergocryptine Bromocriptine Impurity 1 5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione 12'-Hydroxy-2'-isopropyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione [5'α(S)]-12'-Hydroxy-2'-(1-Methylethyl)-5'-(1-Methylpropyl)ergotaMan-3',6',18-trione (5'α)-12'-Hydroxy-2'-(1-Methylethyl)-5'-[(1S)-1-Methylpropyl]ergotaMan-3',6',18-trione Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-[(1S)-1-methylpropyl]-, (5'α)- |
| CAS | 20315-46-2 |
| EINECS | 243-728-6 |
5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione - Physico-chemical Properties
| Molecular Formula | C32H41N5O5 |
| Molar Mass | 575.7 |
| Density | 1.38±0.1 g/cm3(Predicted) |
| Melting Point | 173° (dec) |
| Boling Point | 861.5±65.0 °C(Predicted) |
| Specific Rotation(α) | D20 -98° (c = 0.5 in pyridine); -179° (c = 0.5 in chloroform) |
| pKa | 9.61±0.60(Predicted) |
5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione - Risk and Safety
| UN IDs | 1544 |
| Hazard Class | 6.1(b) |
| Packing Group | III |
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5'alpha(S)-sec-butyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
2-Fluorophenyl(4-fluorophenyl) ketone
2-Fluorophenyl(4-fluorophenyl) ketone