But-1-yne-3-ene, 4-dimethylamino-
TL;DR: But-1-yne-3-ene, 4-dimethylamino- (CAS 61786-08-1) is a chemical compound with molecular formula C6H9N and molecular weight 95.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N,N-dimethylbut-1-en-3-yn-1-amine
Also Known As: But-1-yne-3-ene, 4-dimethylamino-, (E)-(CH3)2NCH=CHC.equiv.CH, N,N-dimethylbut-1-en-3-yn-1-amine, (E)-N,N-dimethylbut-1-en-3-yn-1-amine, RefChem:1080217
| Molecular Formula | C6H9N |
|---|---|
| Molecular Weight | 95.07 g/mol |
| LogP | 0.6949 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 95.0735 |
| Heavy Atoms | 7 |
| Complexity | 95.23787 |
Chemical Identifiers
| CAS Number | 61786-08-1 |
|---|---|
| SMILES | CN(C)/C=C/C#C |
Product Overview
But-1-yne-3-ene, 4-dimethylamino- (CAS 61786-08-1), with molecular formula C6H9N and molecular weight 95.07 g/mol. IUPAC: (E)-N,N-dimethylbut-1-en-3-yn-1-amine.
Chemical Property Profile of But-1-yne-3-ene, 4-dimethylamino-
Property Insights of But-1-yne-3-ene, 4-dimethylamino-
The XLogP value of 0.6949 suggests moderate lipophilicity, balancing water solubility and membrane permeability for But-1-yne-3-ene, 4-dimethylamino-. With a topological polar surface area (TPSA) of 3.24 Ų, But-1-yne-3-ene, 4-dimethylamino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, But-1-yne-3-ene, 4-dimethylamino- has 0 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 But-1-yne-3-ene, 4-dimethylamino-?
The CAS number of But-1-yne-3-ene, 4-dimethylamino- is 61786-08-1.
What is the molecular formula of But-1-yne-3-ene, 4-dimethylamino-?
The molecular formula of But-1-yne-3-ene, 4-dimethylamino- is C6H9N.
What is the molecular weight of But-1-yne-3-ene, 4-dimethylamino-?
The molecular weight of But-1-yne-3-ene, 4-dimethylamino- is 95.07 g/mol.
Where can I buy But-1-yne-3-ene, 4-dimethylamino-?
You can request a quote for But-1-yne-3-ene, 4-dimethylamino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for But-1-yne-3-ene, 4-dimethylamino-?
Yes, KEHONG BIO provides custom synthesis services for But-1-yne-3-ene, 4-dimethylamino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.