N,N-双(2-氯乙基)丙胺
TL;DR: N,N-双(2-氯乙基)丙胺 (CAS 621-68-1) is a chemical compound with molecular formula C7H15Cl2N and molecular weight 183.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-双(2-氯乙基)丙胺
N,N-bis(2-chloroethyl)propan-1-amine
Also Known As: n,n-bis(2-chloroethyl)propan-1-amine, Propylamine, N,N-bis(2-chloroethyl)-, Propylbis(beta-chloroethyl)amine, NCIOpen2_003591, N,N-Bis(2-chloroethyl)propylamine
| Molecular Formula | C7H15Cl2N |
|---|---|
| Molecular Weight | 183.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 183.05815 |
| Heavy Atoms | 10 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 621-68-1 |
|---|---|
| SMILES | CCCN(CCCl)CCCl |
| InChIKey | XPOTXXGDCPYFGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-双(2-氯乙基)丙胺 (CAS 621-68-1), with molecular formula C7H15Cl2N and molecular weight 183.06 g/mol. IUPAC: N,N-bis(2-chloroethyl)propan-1-amine.
Chemical Property Profile of N,N-双(2-氯乙基)丙胺
Property Insights of N,N-双(2-氯乙基)丙胺
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-双(2-氯乙基)丙胺. With a topological polar surface area (TPSA) of 3.2 Ų, N,N-双(2-氯乙基)丙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-双(2-氯乙基)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 N,N-双(2-氯乙基)丙胺?
The CAS number of N,N-双(2-氯乙基)丙胺 is 621-68-1.
What is the molecular formula of N,N-双(2-氯乙基)丙胺?
The molecular formula of N,N-双(2-氯乙基)丙胺 is C7H15Cl2N.
What is the molecular weight of N,N-双(2-氯乙基)丙胺?
The molecular weight of N,N-双(2-氯乙基)丙胺 is 183.06 g/mol.
Where can I buy N,N-双(2-氯乙基)丙胺?
You can request a quote for N,N-双(2-氯乙基)丙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-双(2-氯乙基)丙胺?
Yes, KEHONG BIO provides custom synthesis services for N,N-双(2-氯乙基)丙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.