Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-
TL;DR: Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- (CAS 82894-36-8) is a chemical compound with molecular formula C16H25Cl2NO and molecular weight 317.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-4-hexoxyaniline
Also Known As: N,N-Bis(2-chloroethyl)-p-hexyloxyaniline, N,N-bis(2-chloroethyl)-4-hexoxyaniline, ANILINE, N,N-BIS(2-CHLOROETHYL)-p-HEXYLOXY-, p-N,N-Bis(2-chloroethyl)aminophenol hexyl ether, N,N-bis(2-chloroethyl)-4-(hexyloxy)aniline
| Molecular Formula | C16H25Cl2NO |
|---|---|
| Molecular Weight | 317.13 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 317.13132 |
| Heavy Atoms | 20 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 82894-36-8 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)N(CCCl)CCCl |
| InChIKey | DDYJOWOZCRCCNY-UHFFFAOYSA-N |
Product Overview
Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- (CAS 82894-36-8), with molecular formula C16H25Cl2NO and molecular weight 317.13 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-hexoxyaniline.
Chemical Property Profile of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-
Property Insights of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-
The XLogP value of 5.5 indicates that Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-?
The CAS number of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- is 82894-36-8.
What is the molecular formula of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-?
The molecular formula of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- is C16H25Cl2NO.
What is the molecular weight of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-?
The molecular weight of Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- is 317.13 g/mol.
Where can I buy Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-?
You can request a quote for Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.