N-丁基-N-氯-1-丁胺
TL;DR: N-丁基-N-氯-1-丁胺 (CAS 999-33-7) is a chemical compound with molecular formula C8H18ClN and molecular weight 163.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-丁基-N-氯-1-丁胺
N-butyl-N-chlorobutan-1-amine
Also Known As: Dibutylchloramine, N-BUTYL-N-CHLORO-1-BUTANAMINE, Chlorodibutylamine, N-Chlor-dibutylamin, dibutyl(chloro)amine
| Molecular Formula | C8H18ClN |
|---|---|
| Molecular Weight | 163.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 163.11278 |
| Heavy Atoms | 10 |
| Complexity | 58.0 |
Chemical Identifiers
| CAS Number | 999-33-7 |
|---|---|
| SMILES | CCCCN(CCCC)Cl |
| InChIKey | QZYWEVKTBJKUPB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-丁基-N-氯-1-丁胺 (CAS 999-33-7), with molecular formula C8H18ClN and molecular weight 163.11 g/mol. IUPAC: N-butyl-N-chlorobutan-1-amine.
Chemical Property Profile of N-丁基-N-氯-1-丁胺
Property Insights of N-丁基-N-氯-1-丁胺
The XLogP value of 3.1 indicates that N-丁基-N-氯-1-丁胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, N-丁基-N-氯-1-丁胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-丁基-N-氯-1-丁胺 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 N-丁基-N-氯-1-丁胺?
The CAS number of N-丁基-N-氯-1-丁胺 is 999-33-7.
What is the molecular formula of N-丁基-N-氯-1-丁胺?
The molecular formula of N-丁基-N-氯-1-丁胺 is C8H18ClN.
What is the molecular weight of N-丁基-N-氯-1-丁胺?
The molecular weight of N-丁基-N-氯-1-丁胺 is 163.11 g/mol.
Where can I buy N-丁基-N-氯-1-丁胺?
You can request a quote for N-丁基-N-氯-1-丁胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-丁基-N-氯-1-丁胺?
Yes, KEHONG BIO provides custom synthesis services for N-丁基-N-氯-1-丁胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.