72821-79-5

Name 6-(2-PROPENYL)-ERGOLINE-8-CARBOXYLIC ACID METHYL ESTER
CAS 72821-79-5
Molecular Formula C19H22N2O2
MDL Number MFCD07368166
Molecular Weight 310.4
MOL File 72821-79-5.mol
show more

Chemical Properties

Melting point  146-149 °C
Boiling point  474.1±45.0 °C(Predicted)
density  1.190±0.06 g/cm3(Predicted)
solubility  DMSO (Slightly), Methanol (Slightly), Pyridine (Slightly)
form  Solid
pka 17.52±0.40(Predicted)
color  Pale Grey to Pale Purple
InChI InChI=1/C19H22N2O2/c1-3-7-21-11-13(19(22)23-2)8-15-14-5-4-6-16-18(14)12(10-20-16)9-17(15)21/h3-6,10,13,15,17,20H,1,7-9,11H2,2H3/t13-,15-,17-/s3
InChIKey IACRGBGBDYCBKO-FLWGNPJANA-N
SMILES C(N1C[C@H](C(=O)OC)C[C@]2([H])C3=CC=CC4NC=C(C3=4)C[C@@]12[H])C=C |&1:3,9,21,r|

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H332-H312
Precautionary statements  P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
HazardClass  IRRITANT

Hazard Information

Supplier

Send Inquriy