Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride
TL;DR: Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride (CAS 29242-15-7) is a chemical compound with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(dimethylamino)methyl]xanthen-9-one;hydrochloride
Also Known As: 4-(Dimethylamino)methylxanthen-9-one hydrochloride, Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride, 4-(dimethylaminomethyl)xanthen-9-one hydrochloride, 4-[(dimethylamino)methyl]xanthen-9-one,hydrochloride, Xanthen-9-one, 4-[(dimethylamino)methyl]-, hydrochloride
| Molecular Formula | C16H16ClNO2 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 3.4296 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.08694 |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 29242-15-7 |
|---|---|
| SMILES | CN(C)CC1=C2C(=CC=C1)C(=O)C3=CC=CC=C3O2.Cl |
| InChIKey | XOYVZSAJTRKLEA-UHFFFAOYSA-N |
Product Overview
Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride (CAS 29242-15-7), with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol. IUPAC: 4-[(dimethylamino)methyl]xanthen-9-one;hydrochloride.
Chemical Property Profile of Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride
Property Insights of Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride
The XLogP value of 3.4296 indicates that Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride 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 Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride?
The CAS number of Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride is 29242-15-7.
What is the molecular formula of Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride?
The molecular formula of Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride is C16H16ClNO2.
What is the molecular weight of Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride?
The molecular weight of Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride is 289.09 g/mol.
Where can I buy Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride?
You can request a quote for Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Xanthen-9-one, 4-(dimethylamino)methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.