C18H20ClNO2.ClH
TL;DR: C18H20ClNO2.ClH (CAS 3042-75-9) is a chemical compound with molecular formula C18H21Cl2NO2 and molecular weight 353.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 2-chloro-2,2-diphenylacetate;hydrochloride
Also Known As: Benzeneacetic acid, alpha-chloro-alpha-phenyl-, 2-(dimethylamino)ethyl ester, hydrochloride, 2-dimethylaminoethyl 2-chloro-2,2-diphenylacetate hydrochloride, 2-(Dimethylamino)ethyl 2-chloro-2,2-diphenylacetate Hydrochloride, 2-(dimethylamino)ethyl 2-chloro-2,2-diphenylacetate;hydrochloride, 2-(Dimethylamino)ethyl chlorodi(phenyl)acetate--hydrogen chloride (1/1)
| Molecular Formula | C18H21Cl2NO2 |
|---|---|
| Molecular Weight | 353.09 g/mol |
| LogP | 3.6956 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.09494 |
| Heavy Atoms | 23 |
| Complexity | 563.43335 |
Chemical Identifiers
| CAS Number | 3042-75-9 |
|---|---|
| SMILES | CN(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)Cl.Cl |
Product Overview
C18H20ClNO2.ClH (CAS 3042-75-9), with molecular formula C18H21Cl2NO2 and molecular weight 353.09 g/mol. IUPAC: 2-(dimethylamino)ethyl 2-chloro-2,2-diphenylacetate;hydrochloride.
Chemical Property Profile of C18H20ClNO2.ClH
Property Insights of C18H20ClNO2.ClH
The XLogP value of 3.6956 indicates that C18H20ClNO2.ClH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, C18H20ClNO2.ClH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C18H20ClNO2.ClH has 0 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 C18H20ClNO2.ClH?
The CAS number of C18H20ClNO2.ClH is 3042-75-9.
What is the molecular formula of C18H20ClNO2.ClH?
The molecular formula of C18H20ClNO2.ClH is C18H21Cl2NO2.
What is the molecular weight of C18H20ClNO2.ClH?
The molecular weight of C18H20ClNO2.ClH is 353.09 g/mol.
Where can I buy C18H20ClNO2.ClH?
You can request a quote for C18H20ClNO2.ClH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C18H20ClNO2.ClH?
Yes, KEHONG BIO provides custom synthesis services for C18H20ClNO2.ClH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.