![Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate structure](/static/products/6858/68588-50-1.webp)
Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate
TL;DR: Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate (CAS 68588-50-1) is a chemical compound with molecular formula C33H51ClN2O6 and molecular weight 606.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-3-oxopentanoyl)amino]benzoate
Also Known As: EINECS 271-612-5, Dodecyl 4-chloro-3,5-bis((4,4-dimethyl-1,3-dioxopentyl)amino)benzoate, DODECYL 4-CHLORO-3,5-BIS[(4,4-DIMETHYL-1,3-DIOXOPENTYL)AMINO]BENZOATE, DODECYL 4-CHLORO-3,5-BIS(4,4-DIMETHYL-3-OXOPENTANAMIDO)BENZOATE, dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-3-oxopentanoyl)amino]benzoate
| Molecular Formula | C33H51ClN2O6 |
|---|---|
| Molecular Weight | 606.34 g/mol |
| LogP | 8.3053 |
| Topological Polar Surface Area | 118.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 606.34357 |
| Heavy Atoms | 42 |
| Complexity | 1021.9874 |
Chemical Identifiers
| CAS Number | 68588-50-1 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)NC(=O)CC(=O)C(C)(C)C)Cl)NC(=O)CC(=O)C(C)(C)C |
Product Overview
Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate (CAS 68588-50-1), with molecular formula C33H51ClN2O6 and molecular weight 606.34 g/mol. IUPAC: dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-3-oxopentanoyl)amino]benzoate.
Chemical Property Profile of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate
Property Insights of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate
The XLogP value of 8.3053 indicates that Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate. Following Lipinski's Rule of Five, Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate?
The CAS number of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate is 68588-50-1.
What is the molecular formula of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate?
The molecular formula of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate is C33H51ClN2O6.
What is the molecular weight of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate?
The molecular weight of Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate is 606.34 g/mol.
Where can I buy Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate?
You can request a quote for Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Dodecyl 4-chloro-3,5-bis[(4,4-dimethyl-1,3-dioxopentyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.