4-丙基庚-1-炔-4-胺
TL;DR: 4-丙基庚-1-炔-4-胺 (CAS 61822-44-4) is a chemical compound with molecular formula C10H19N and molecular weight 153.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-丙基庚-1-炔-4-胺
4-propylhept-1-yn-4-amine
Also Known As: 4-propylhept-1-yn-4-amine, 1,1-Di-n-propyl-3-butyn-1-ylamine
| Molecular Formula | C10H19N |
|---|---|
| Molecular Weight | 153.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 153.15175 |
| Heavy Atoms | 11 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 61822-44-4 |
|---|---|
| SMILES | CCCC(CCC)(CC#C)N |
| InChIKey | VVMYLTXQMMVPDP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-丙基庚-1-炔-4-胺 (CAS 61822-44-4), with molecular formula C10H19N and molecular weight 153.15 g/mol. IUPAC: 4-propylhept-1-yn-4-amine.
Chemical Property Profile of 4-丙基庚-1-炔-4-胺
Property Insights of 4-丙基庚-1-炔-4-胺
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-丙基庚-1-炔-4-胺. With a topological polar surface area (TPSA) of 26.0 Ų, 4-丙基庚-1-炔-4-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-丙基庚-1-炔-4-胺 has 1 hydrogen bond donor(s) and 1 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 4-丙基庚-1-炔-4-胺?
The CAS number of 4-丙基庚-1-炔-4-胺 is 61822-44-4.
What is the molecular formula of 4-丙基庚-1-炔-4-胺?
The molecular formula of 4-丙基庚-1-炔-4-胺 is C10H19N.
What is the molecular weight of 4-丙基庚-1-炔-4-胺?
The molecular weight of 4-丙基庚-1-炔-4-胺 is 153.15 g/mol.
Where can I buy 4-丙基庚-1-炔-4-胺?
You can request a quote for 4-丙基庚-1-炔-4-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-丙基庚-1-炔-4-胺?
Yes, KEHONG BIO provides custom synthesis services for 4-丙基庚-1-炔-4-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.