N-(3-氯丙基)二甲胺
TL;DR: N-(3-氯丙基)二甲胺 (CAS 109-54-6) is a chemical compound with molecular formula C5H12ClN and molecular weight 121.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-氯丙基)二甲胺
3-chloro-N,N-dimethylpropan-1-amine
Also Known As: 3-chloro-N,N-dimethylpropan-1-amine, 3-Chloro-1-(N,N-dimethyl)propylamine, Dimethylaminopropyl chloride, (3-chloropropyl)dimethylamine, 3-Chloro-N,N-dimethyl-1-propanamine
| Molecular Formula | C5H12ClN |
|---|---|
| Molecular Weight | 121.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 121.06583 |
| Heavy Atoms | 7 |
| Complexity | 37.0 |
Chemical Identifiers
| CAS Number | 109-54-6 |
|---|---|
| SMILES | CN(C)CCCCl |
| InChIKey | NYYRRBOMNHUCLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3-氯丙基)二甲胺 (CAS 109-54-6), with molecular formula C5H12ClN and molecular weight 121.07 g/mol. IUPAC: 3-chloro-N,N-dimethylpropan-1-amine.
Chemical Property Profile of N-(3-氯丙基)二甲胺
Property Insights of N-(3-氯丙基)二甲胺
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-氯丙基)二甲胺. With a topological polar surface area (TPSA) of 3.2 Ų, N-(3-氯丙基)二甲胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-氯丙基)二甲胺 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-(3-氯丙基)二甲胺?
The CAS number of N-(3-氯丙基)二甲胺 is 109-54-6.
What is the molecular formula of N-(3-氯丙基)二甲胺?
The molecular formula of N-(3-氯丙基)二甲胺 is C5H12ClN.
What is the molecular weight of N-(3-氯丙基)二甲胺?
The molecular weight of N-(3-氯丙基)二甲胺 is 121.07 g/mol.
Where can I buy N-(3-氯丙基)二甲胺?
You can request a quote for N-(3-氯丙基)二甲胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-氯丙基)二甲胺?
Yes, KEHONG BIO provides custom synthesis services for N-(3-氯丙基)二甲胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.