1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)
TL;DR: 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) (CAS 3085-79-8) is a chemical compound with molecular formula C13H30IN and molecular weight 327.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tributyl(methyl)azanium iodide
Also Known As: Tributylmethylammonium iodide, METHYLTRIBUTYLAMMONIUM IODIDE, tributyl(methyl)azanium iodide, Tri-n-butylmethylammonium, TBuMA
| Molecular Formula | C13H30IN |
|---|---|
| Molecular Weight | 327.14 g/mol |
| LogP | 0.84 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 327.1423 |
| Heavy Atoms | 15 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 3085-79-8 |
|---|---|
| SMILES | CCCC[N+](C)(CCCC)CCCC.[I-] |
| InChIKey | DXJLCRNXYNRGRA-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) (CAS 3085-79-8), with molecular formula C13H30IN and molecular weight 327.14 g/mol. IUPAC: tributyl(methyl)azanium iodide.
Chemical Property Profile of 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)
Property Insights of 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)
The XLogP value of 0.84 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1). With a topological polar surface area (TPSA) of 0.0 Ų, 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) 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 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)?
The CAS number of 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) is 3085-79-8.
What is the molecular formula of 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)?
The molecular formula of 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) is C13H30IN.
What is the molecular weight of 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)?
The molecular weight of 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) is 327.14 g/mol.
Where can I buy 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)?
You can request a quote for 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanaminium, N,N-dibutyl-N-methyl-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.