2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)
TL;DR: 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) (CAS 631-00-5) is a chemical compound with molecular formula C20H32ClNO3 and molecular weight 369.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-cyclohexyl-2-hydroxy-2-phenylacetate;hydrochloride
Also Known As: IT 15, NIOSH/MC5293000, (+)-alpha-Phenylcyclohexaneglycolic acid 2-(diethylamino)ethyl ester hydrochloride, (+-)-alpha-Phenylcyclohexaneglycolic acid 2-(diethylamino)ethyl ester hydrochloride, Cyclohexaneglycolic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride, (+)-
| Molecular Formula | C20H32ClNO3 |
|---|---|
| Molecular Weight | 369.21 g/mol |
| LogP | 3.7613 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 369.20706 |
| Heavy Atoms | 25 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 631-00-5 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.Cl |
| InChIKey | DLQDCDHQWWCMRS-UHFFFAOYSA-N |
Product Overview
2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) (CAS 631-00-5), with molecular formula C20H32ClNO3 and molecular weight 369.21 g/mol. IUPAC: 2-(diethylamino)ethyl 2-cyclohexyl-2-hydroxy-2-phenylacetate;hydrochloride.
Chemical Property Profile of 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)
Property Insights of 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)
The XLogP value of 3.7613 indicates that 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) has 2 hydrogen bond donor(s) and 4 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 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)?
The CAS number of 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) is 631-00-5.
What is the molecular formula of 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)?
The molecular formula of 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) is C20H32ClNO3.
What is the molecular weight of 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)?
The molecular weight of 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) is 369.21 g/mol.
Where can I buy 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)?
You can request a quote for 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino)ethyl cyclohexyl(hydroxy)phenylacetate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.