RefChem:1075745
TL;DR: RefChem:1075745 (CAS 66827-50-7) is a chemical compound with molecular formula C20H38ClNO2 and molecular weight 359.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-cyclohexylpent-4-enoyloxy)-2,2-dimethylpropyl]-diethylazanium chloride
Also Known As: Acetic acid, 2-allyl-2-cyclohexyl-, 3-(diethylamino)-2,2-dimethylpropyl ester, hydrochloride, 2-Allyl-2-cyclohexylacetic acid 3-(diethylamino)-2,2-dimethylpropyl ester hydrochloride, Cyclohexylallyl-essigsaeureester des 3-diaethylamino-2,2-dimethyl-1-propanol [German], [3-(2-Cyclohexylpent-4-enoyloxy)-2,2-dimethylpropyl]-diethylazaniumchloride, Cyclohexylallyl-essigsaeureester des 3-diaethylamino-2,2-dimethyl-1-propanol
| Molecular Formula | C20H38ClNO2 |
|---|---|
| Molecular Weight | 359.26 g/mol |
| LogP | 0.26 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 359.2591 |
| Heavy Atoms | 24 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 66827-50-7 |
|---|---|
| SMILES | CC[NH+](CC)CC(C)(C)COC(=O)C(CC=C)C1CCCCC1.[Cl-] |
| InChIKey | CLWDWMYAIBFDFV-UHFFFAOYSA-N |
Product Overview
RefChem:1075745 (CAS 66827-50-7), with molecular formula C20H38ClNO2 and molecular weight 359.26 g/mol. IUPAC: [3-(2-cyclohexylpent-4-enoyloxy)-2,2-dimethylpropyl]-diethylazanium chloride.
Chemical Property Profile of RefChem:1075745
Property Insights of RefChem:1075745
The XLogP value of 0.26 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1075745. With a topological polar surface area (TPSA) of 30.7 Ų, RefChem:1075745 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1075745 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 RefChem:1075745?
The CAS number of RefChem:1075745 is 66827-50-7.
What is the molecular formula of RefChem:1075745?
The molecular formula of RefChem:1075745 is C20H38ClNO2.
What is the molecular weight of RefChem:1075745?
The molecular weight of RefChem:1075745 is 359.26 g/mol.
Where can I buy RefChem:1075745?
You can request a quote for RefChem:1075745 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075745?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075745 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.