HELEURINE
TL;DR: HELEURINE (CAS 488-00-6) is a chemical compound with molecular formula C16H27NO4 and molecular weight 297.194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,6,7,8-tetrahydro-3H-pyrrolizin-1-ylmethyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate
Also Known As: HELEURINE, Homogentisic acid, O(sup 3)-Methylsupinidine, 4-21-00-00327 (Beilstein Handbook Reference), (2R)-2-Hydroxy-2-[(R)-1-methoxyethyl]-3-methylbutanoic acid [(7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester
Technical Specifications
| Molecular Formula | C16H27NO4 |
| Molecular Weight | 297.194 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 297.194 Da |
| Heavy Atoms | 21 |
| Complexity | 421.0 |
| SMILES | CC(C)C(C(C)OC)(C(=O)OCC1=CCN2C1CCC2)O |
| InChIKey | AORFDVNAPHMKAU-UHFFFAOYSA-N |
Product Description
Applications: HELEURINE 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).
HELEURINE (CAS 488-00-6) is a fine chemical with the molecular formula C16H27NO4 and a molecular weight of 297.19 g/mol. Synonyms include HELEURINE and Homogentisic acid.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of HELEURINE
Property Insights of HELEURINE
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for HELEURINE. With a topological polar surface area (TPSA) of 59.0 Ų, HELEURINE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, HELEURINE has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of HELEURINE?
The CAS number of HELEURINE is 488-00-6.
What is the molecular formula of HELEURINE?
The molecular formula of HELEURINE is C16H27NO4.
What is the molecular weight of HELEURINE?
The molecular weight of HELEURINE is 297.194 g/mol.
What are the applications of HELEURINE?
HELEURINE 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 HELEURINE?
You can request a quote for HELEURINE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for HELEURINE?
Yes, CoreyChem provides custom synthesis services for HELEURINE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.