![6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline structure](/static/products/7220/72204-77-4.webp)
6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline
TL;DR: 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline (CAS 72204-77-4) is a chemical compound with molecular formula C28H50ClN and molecular weight 435.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline
Also Known As: 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline, 1-(2-Chloroethyl)-4a,6a-dimethyl-7-(6-methylheptan-2-yl)hexadecahydro-1H-indeno[5,4-f]quinoline
| Molecular Formula | C28H50ClN |
|---|---|
| Molecular Weight | 435.36 g/mol |
| LogP | 9.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 435.3632 |
| Heavy Atoms | 30 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 72204-77-4 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCCN4CCCl)C)C |
| InChIKey | ZYVCMFKFIZHJHF-UHFFFAOYSA-N |
Product Overview
6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline (CAS 72204-77-4), with molecular formula C28H50ClN and molecular weight 435.36 g/mol. IUPAC: 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline.
Chemical Property Profile of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline
Property Insights of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline
The XLogP value of 9.7 indicates that 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline?
The CAS number of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline is 72204-77-4.
What is the molecular formula of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline?
The molecular formula of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline is C28H50ClN.
What is the molecular weight of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline?
The molecular weight of 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline is 435.36 g/mol.
Where can I buy 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline?
You can request a quote for 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline?
Yes, KEHONG BIO provides custom synthesis services for 6-(2-chloroethyl)-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5,5a,7,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.