2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol
TL;DR: 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol (CAS 91564-12-4) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-7-morpholin-4-ylhepta-3,5-diyn-2-ol
Also Known As: 2-methyl-7-morpholino-3,5-heptadiyn-2-ol, 2-methyl-7-morpholinohepta-3,5-diyn-2-ol, 2-methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol, 2-methyl-7-morpholin-4-ylhepta-3,5-diyn-2-ol, REGID_for_CID_665385
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 91564-12-4 |
|---|---|
| SMILES | CC(C)(C#CC#CCN1CCOCC1)O |
| InChIKey | VJYMWNZRVJBNGM-UHFFFAOYSA-N |
Product Overview
2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol (CAS 91564-12-4), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: 2-methyl-7-morpholin-4-ylhepta-3,5-diyn-2-ol.
Chemical Property Profile of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol
Property Insights of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol. With a topological polar surface area (TPSA) of 32.7 Ų, 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol?
The CAS number of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol is 91564-12-4.
What is the molecular formula of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol?
The molecular formula of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol is C12H17NO2.
What is the molecular weight of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol?
The molecular weight of 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol is 207.13 g/mol.
Where can I buy 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol?
You can request a quote for 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-7-(morpholin-4-yl)hepta-3,5-diyn-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.