RefChem:1061779
TL;DR: RefChem:1061779 (CAS 58880-38-9) is a chemical compound with molecular formula C20H30ClNO2 and molecular weight 351.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-cyclohexylphenyl)cyclopropanecarbonyl]oxyethyl-dimethylazanium chloride
Also Known As: 1-(4-Cyclohexylphenyl)cyclopropanecarboxylic acid 2-(dimethylamino)ethyl ester, 2-[1-(4-Cyclohexylphenyl)cyclopropanecarbonyl]oxyethyl-dimethylazaniumchloride, Cyclopropanecarboxylic acid, 1-(4-cyclohexylphenyl)-, 2-(dimethylamino)ethyl ester, hydrochloride, 2-[1-(4-cyclohexylphenyl)cyclopropanecarbonyl]oxyethyl-dimethylazanium chloride, 2-(Dimethylamino)ethyl 1-(4-cyclohexylphenyl)cyclopropane-1-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C20H30ClNO2 |
|---|---|
| Molecular Weight | 351.20 g/mol |
| LogP | -0.54 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.1965 |
| Heavy Atoms | 24 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 58880-38-9 |
|---|---|
| SMILES | C[NH+](C)CCOC(=O)C1(CC1)C2=CC=C(C=C2)C3CCCCC3.[Cl-] |
| InChIKey | LDZOQNALMYQZLX-UHFFFAOYSA-N |
Product Overview
RefChem:1061779 (CAS 58880-38-9), with molecular formula C20H30ClNO2 and molecular weight 351.20 g/mol. IUPAC: 2-[1-(4-cyclohexylphenyl)cyclopropanecarbonyl]oxyethyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:1061779
Property Insights of RefChem:1061779
The XLogP value of -0.54 indicates that RefChem:1061779 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, RefChem:1061779 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1061779 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:1061779?
The CAS number of RefChem:1061779 is 58880-38-9.
What is the molecular formula of RefChem:1061779?
The molecular formula of RefChem:1061779 is C20H30ClNO2.
What is the molecular weight of RefChem:1061779?
The molecular weight of RefChem:1061779 is 351.20 g/mol.
Where can I buy RefChem:1061779?
You can request a quote for RefChem:1061779 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1061779?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1061779 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.