5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
TL;DR: 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (CAS 5984-50-9) is a chemical compound with molecular formula C13H25NO6 and molecular weight 291.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R)-2,3-dihydroxybutanedioic acid;N,6-dimethylhept-5-en-2-amine
Also Known As: Octin bitartrate, Isometheptene bitartrate, 2-Methylamino-iso-octene bitartrate, isometheptene, monotartrate, ISOMETHEPTENE TARTRATE
| Molecular Formula | C13H25NO6 |
|---|---|
| Molecular Weight | 291.17 g/mol |
| LogP | 0.22 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.16818 |
| Heavy Atoms | 20 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 5984-50-9 |
|---|---|
| SMILES | CC(CCC=C(C)C)NC.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
| InChIKey | HLRDXBKIKFQOFS-LREBCSMRSA-N |
Product Overview
5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (CAS 5984-50-9), with molecular formula C13H25NO6 and molecular weight 291.17 g/mol. IUPAC: (2R,3R)-2,3-dihydroxybutanedioic acid;N,6-dimethylhept-5-en-2-amine.
Chemical Property Profile of 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
Property Insights of 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
The XLogP value of 0.22 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1). The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1). Following Lipinski's Rule of Five, 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) has 5 hydrogen bond donor(s) and 7 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 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)?
The CAS number of 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) is 5984-50-9.
What is the molecular formula of 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)?
The molecular formula of 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) is C13H25NO6.
What is the molecular weight of 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)?
The molecular weight of 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) is 291.17 g/mol.
Where can I buy 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)?
You can request a quote for 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 5-Hepten-2-amine, N,6-dimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.