Ergotamine Tartrate
TL;DR: Ergotamine Tartrate (CAS 379-79-3) is a chemical compound with molecular formula C70H76N10O16 and molecular weight 1312.5441 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis((6aR,9R)-N-[(1S,2S,4R,7S)-7-benzyl-2-hydroxy-4-methyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide);(2R,3R)-2,3-dihydroxybutanedioic acid
Also Known As: ergotamine tartrate, Ergostat, Lingraine, Wigrettes, Ergotamine D-tartrate
Technical Specifications
| Molecular Formula | C70H76N10O16 |
| Molecular Weight | 1312.5441 g/mol |
| XLogP | 1.86 |
| Topological Polar Surface Area (TPSA) | 351.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 11 |
| Exact Mass | 1312.5441 Da |
| Heavy Atoms | 96 |
| Complexity | 1350.0 |
| Melting Point | 397 °F decomposes (EPA, 1998) |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| SMILES | C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
| InChIKey | CJMJLDQKTOJACI-BGQAIRJTSA-N |
Product Description
Applications: Ergotamine Tartrate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Ergotamine Tartrate (CAS 379-79-3) is a fine chemical with the molecular formula C70H76N10O16 and a molecular weight of 1312.54 g/mol. Key physical properties include a solubility: less than 1 mg/mL at 68 °F (NTP, 1992). Synonyms include ergotamine tartrate and Ergostat.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Ergotamine Tartrate
Property Insights of Ergotamine Tartrate
The XLogP value of 1.86 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ergotamine Tartrate. The TPSA of 351.0 Ų indicates high polarity, suggesting Ergotamine Tartrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ergotamine Tartrate has 10 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ergotamine Tartrate?
The CAS number of Ergotamine Tartrate is 379-79-3.
What is the molecular formula of Ergotamine Tartrate?
The molecular formula of Ergotamine Tartrate is C70H76N10O16.
What is the molecular weight of Ergotamine Tartrate?
The molecular weight of Ergotamine Tartrate is 1312.5441 g/mol.
What are the applications of Ergotamine Tartrate?
Ergotamine Tartrate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy Ergotamine Tartrate?
You can request a quote for Ergotamine Tartrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ergotamine Tartrate?
Yes, CoreyChem provides custom synthesis services for Ergotamine Tartrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.