6-(2-PROPENYL)-ERGOLINE-8-CARBOXYLIC ACID METHYL ESTER
- Product Name6-(2-PROPENYL)-ERGOLINE-8-CARBOXYLIC ACID METHYL ESTER
- CAS72821-79-5
- CBNumberCB8297358
- MFC19H22N2O2
- MW310.4
- MDL NumberMFCD07368166
- MOL File72821-79-5.mol
- MSDS FileSDS
Chemical Properties
| Boiling point | 474.1±45.0 °C(Predicted) |
| Density | 1.190±0.06 g/cm3(Predicted) |
| solubility | DMSO (Slightly), Methanol (Slightly), Pyridine (Slightly) |
| pka | 17.52±0.40(Predicted) |
| form | Solid |
| 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
| Symbol(GHS) |
|
| 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 |
