2-bromo-N,N-diethylprop-2-en-1-amine
TL;DR: 2-bromo-N,N-diethylprop-2-en-1-amine (CAS 13249-59-7) is a chemical compound with molecular formula C7H14BrN and molecular weight 191.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N,N-diethylprop-2-en-1-amine
Also Known As: diethyl-(2-bromo-allyl)-amine, 2-Brom-3-diaethylamino-propen, 2-bromo-N,N-diethylprop-2-en-1-amine, (2-bromoprop-2-en-1-yl)diethylamine
| Molecular Formula | C7H14BrN |
|---|---|
| Molecular Weight | 191.03 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 191.03096 |
| Heavy Atoms | 9 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 13249-59-7 |
|---|---|
| SMILES | CCN(CC)CC(=C)Br |
| InChIKey | TZLOLWXQQZQNPV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-bromo-N,N-diethylprop-2-en-1-amine (CAS 13249-59-7), with molecular formula C7H14BrN and molecular weight 191.03 g/mol. IUPAC: 2-bromo-N,N-diethylprop-2-en-1-amine.
Chemical Property Profile of 2-bromo-N,N-diethylprop-2-en-1-amine
Property Insights of 2-bromo-N,N-diethylprop-2-en-1-amine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-bromo-N,N-diethylprop-2-en-1-amine. With a topological polar surface area (TPSA) of 3.2 Ų, 2-bromo-N,N-diethylprop-2-en-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-bromo-N,N-diethylprop-2-en-1-amine 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 2-bromo-N,N-diethylprop-2-en-1-amine?
The CAS number of 2-bromo-N,N-diethylprop-2-en-1-amine is 13249-59-7.
What is the molecular formula of 2-bromo-N,N-diethylprop-2-en-1-amine?
The molecular formula of 2-bromo-N,N-diethylprop-2-en-1-amine is C7H14BrN.
What is the molecular weight of 2-bromo-N,N-diethylprop-2-en-1-amine?
The molecular weight of 2-bromo-N,N-diethylprop-2-en-1-amine is 191.03 g/mol.
Where can I buy 2-bromo-N,N-diethylprop-2-en-1-amine?
You can request a quote for 2-bromo-N,N-diethylprop-2-en-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-N,N-diethylprop-2-en-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-N,N-diethylprop-2-en-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.