But-3-ynyl-trimethyl-azanium
TL;DR: But-3-ynyl-trimethyl-azanium (CAS 7461-53-2) is a chemical compound with molecular formula C7H14N+ and molecular weight 112.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-3-ynyl(trimethyl)azanium
Also Known As: but-3-ynyl(trimethyl)azanium, BUT-3-YNYL-TRIMETHYL-AZANIUM, N,N,N-Trimethylbut-3-yn-1-aminium
| Molecular Formula | C7H14N+ |
|---|---|
| Molecular Weight | 112.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 112.112625 |
| Heavy Atoms | 8 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 7461-53-2 |
|---|---|
| SMILES | C[N+](C)(C)CCC#C |
| InChIKey | HDKUVCONOTUZOC-UHFFFAOYSA-N |
Product Overview
But-3-ynyl-trimethyl-azanium (CAS 7461-53-2), with molecular formula C7H14N+ and molecular weight 112.11 g/mol. IUPAC: but-3-ynyl(trimethyl)azanium.
Chemical Property Profile of But-3-ynyl-trimethyl-azanium
Property Insights of But-3-ynyl-trimethyl-azanium
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for But-3-ynyl-trimethyl-azanium. With a topological polar surface area (TPSA) of 0.0 Ų, But-3-ynyl-trimethyl-azanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, But-3-ynyl-trimethyl-azanium has 0 hydrogen bond donor(s) and 0 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-3-ynyl-trimethyl-azanium?
The CAS number of But-3-ynyl-trimethyl-azanium is 7461-53-2.
What is the molecular formula of But-3-ynyl-trimethyl-azanium?
The molecular formula of But-3-ynyl-trimethyl-azanium is C7H14N+.
What is the molecular weight of But-3-ynyl-trimethyl-azanium?
The molecular weight of But-3-ynyl-trimethyl-azanium is 112.11 g/mol.
Where can I buy But-3-ynyl-trimethyl-azanium?
You can request a quote for But-3-ynyl-trimethyl-azanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for But-3-ynyl-trimethyl-azanium?
Yes, KEHONG BIO provides custom synthesis services for But-3-ynyl-trimethyl-azanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.