57884-92-1, CAS No 57884-92-1

57884-92-1 5'α-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione methanesulphonate
Product Name	5'α-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione methanesulphonate
Synonyms	5'alpha-Benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione methanesulphonate;(5'alpha)-5'-benzyl-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)ergotaman methanesulfonate (1:1);(5'alpha)-5'-benzyl-2'-(1-methylethyl)-12'-[(methylsulfonyl)oxy]-3',6',18-trioxoergotaman
Molecular Formula	C₃₆H₄₁N₅O₇S
Molecular Weight	687.805
InChl	InChI=1/C36H41N5O7S/c1-21(2)35(38-32(42)24-17-26-25-12-8-13-27-31(25)23(19-37-27)18-28(26)39(3)20-24)34(44)41-29(16-22-10-6-5-7-11-22)33(43)40-15-9-14-30(40)36(41,47-35)48-49(4,45)46/h5-8,10-13,17,19,21,24,28-30,37H,9,14-16,18,20H2,1-4H3,(H,38,42)/t24-,28-,29+,30+,35-,36-/m1/s1
CAS Registry Number	57884-92-1
EINECS	261-004-8
Molecular Structure
Density	1.46g/cm³
Boiling Point	978.2°C at 760 mmHg
Refractive Index	1.703
Flash Point	545.4°C
Vapour Pressur	0mmHg at 25°C

57884-92-1 5'α-benzyl-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione methanesulphonate