N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium
TL;DR: N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium (CAS 131247-65-9) is a chemical compound with molecular formula C12H18Br2N+ and molecular weight 333.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-(2,3-dibromopropyl)-dimethylazanium
Also Known As: (2,3-dibromopropyl)dimethylbenzylamine, benzyl-(2,3-dibromopropyl)-dimethylazanium, N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium, BAS 00525324, Benzyl-(2,3-dibromo-propyl)-dimethyl-ammonium
| Molecular Formula | C12H18Br2N+ |
|---|---|
| Molecular Weight | 333.98 g/mol |
| LogP | 3.4214 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.9806 |
| Heavy Atoms | 15 |
| Complexity | 284.9334 |
Chemical Identifiers
| CAS Number | 131247-65-9 |
|---|---|
| SMILES | C[N+](C)(CC1=CC=CC=C1)CC(CBr)Br |
Product Overview
N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium (CAS 131247-65-9), with molecular formula C12H18Br2N+ and molecular weight 333.98 g/mol. IUPAC: benzyl-(2,3-dibromopropyl)-dimethylazanium.
Chemical Property Profile of N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium
Property Insights of N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium
The XLogP value of 3.4214 indicates that N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium 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 N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium?
The CAS number of N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium is 131247-65-9.
What is the molecular formula of N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium?
The molecular formula of N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium is C12H18Br2N+.
What is the molecular weight of N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium?
The molecular weight of N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium is 333.98 g/mol.
Where can I buy N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium?
You can request a quote for N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2,3-dibromo-N,N-dimethylpropan-1-aminium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.