二乙基丙胺
TL;DR: 二乙基丙胺 (CAS 4458-31-5) is a chemical compound with molecular formula C7H17N and molecular weight 115.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二乙基丙胺
N,N-diethylpropan-1-amine
Also Known As: Diethyl(propyl)amine, Diethylpropylamine, N-(n-Propyl)diethylamine, N,N-diethylpropan-1-amine, N,N-Diethyl propanamine
| Molecular Formula | C7H17N |
|---|---|
| Molecular Weight | 115.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 115.1361 |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
Chemical Identifiers
| CAS Number | 4458-31-5 |
|---|---|
| SMILES | CCCN(CC)CC |
| InChIKey | PQZTVWVYCLIIJY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二乙基丙胺 (CAS 4458-31-5), with molecular formula C7H17N and molecular weight 115.14 g/mol. IUPAC: N,N-diethylpropan-1-amine.
Chemical Property Profile of 二乙基丙胺
Property Insights of 二乙基丙胺
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二乙基丙胺. With a topological polar surface area (TPSA) of 3.2 Ų, 二乙基丙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二乙基丙胺 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 二乙基丙胺?
The CAS number of 二乙基丙胺 is 4458-31-5.
What is the molecular formula of 二乙基丙胺?
The molecular formula of 二乙基丙胺 is C7H17N.
What is the molecular weight of 二乙基丙胺?
The molecular weight of 二乙基丙胺 is 115.14 g/mol.
Where can I buy 二乙基丙胺?
You can request a quote for 二乙基丙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二乙基丙胺?
Yes, KEHONG BIO provides custom synthesis services for 二乙基丙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.