N-丁基-N-亚硝基-1-戊胺
TL;DR: N-丁基-N-亚硝基-1-戊胺 (CAS 16339-05-2) is a chemical compound with molecular formula C9H20N2O and molecular weight 172.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-丁基-N-亚硝基-1-戊胺
N-butyl-N-pentylnitrous amide
Also Known As: Butylamylnitrosamin, N-butyl-N-pentylnitrous amide, N-Butyl-N-amylnitrosamine, N-Butyl-N-nitrosopentylamine, N-Butyl-N-nitrosoamylamine
| Molecular Formula | C9H20N2O |
|---|---|
| Molecular Weight | 172.16 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 172.15756 |
| Heavy Atoms | 12 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 16339-05-2 |
|---|---|
| SMILES | CCCCCN(CCCC)N=O |
| InChIKey | PGJREAGDCYDOOF-UHFFFAOYSA-N |
Product Overview
N-丁基-N-亚硝基-1-戊胺 (CAS 16339-05-2), with molecular formula C9H20N2O and molecular weight 172.16 g/mol. IUPAC: N-butyl-N-pentylnitrous amide.
Chemical Property Profile of N-丁基-N-亚硝基-1-戊胺
Property Insights of N-丁基-N-亚硝基-1-戊胺
The XLogP value of 3.2 indicates that N-丁基-N-亚硝基-1-戊胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, N-丁基-N-亚硝基-1-戊胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-丁基-N-亚硝基-1-戊胺 has 0 hydrogen bond donor(s) and 3 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-亚硝基-1-戊胺?
The CAS number of N-丁基-N-亚硝基-1-戊胺 is 16339-05-2.
What is the molecular formula of N-丁基-N-亚硝基-1-戊胺?
The molecular formula of N-丁基-N-亚硝基-1-戊胺 is C9H20N2O.
What is the molecular weight of N-丁基-N-亚硝基-1-戊胺?
The molecular weight of N-丁基-N-亚硝基-1-戊胺 is 172.16 g/mol.
Where can I buy N-丁基-N-亚硝基-1-戊胺?
You can request a quote for N-丁基-N-亚硝基-1-戊胺 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-亚硝基-1-戊胺?
Yes, KEHONG BIO provides custom synthesis services for N-丁基-N-亚硝基-1-戊胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.