![2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol structure](/static/products/1691/1691-86-7.webp)
2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol
TL;DR: 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol (CAS 1691-86-7) is a chemical compound with molecular formula C16H18Cl2FNO and molecular weight 329.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol
Also Known As: 2-[bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol, 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethan-1-ol, 1-Naphthalenemethanol, a-[[bis(2-chloroethyl)amino]methyl]-4-fluoro-
| Molecular Formula | C16H18Cl2FNO |
|---|---|
| Molecular Weight | 329.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 329.07495 |
| Heavy Atoms | 21 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 1691-86-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2F)C(CN(CCCl)CCCl)O |
| InChIKey | MBNALHRMCHYAFI-UHFFFAOYSA-N |
Product Overview
2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol (CAS 1691-86-7), with molecular formula C16H18Cl2FNO and molecular weight 329.07 g/mol. IUPAC: 2-[bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol.
Chemical Property Profile of 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol
Property Insights of 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol
The XLogP value of 3.6 indicates that 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol has 1 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 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol?
The CAS number of 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol is 1691-86-7.
What is the molecular formula of 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol?
The molecular formula of 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol is C16H18Cl2FNO.
What is the molecular weight of 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol?
The molecular weight of 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol is 329.07 g/mol.
Where can I buy 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol?
You can request a quote for 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[Bis(2-chloroethyl)amino]-1-(4-fluoronaphthalen-1-yl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.