beta-Methylaminoethyl benzhydryl ether hydrochloride
TL;DR: beta-Methylaminoethyl benzhydryl ether hydrochloride (CAS 53499-40-4) is a chemical compound with molecular formula C16H20ClNO and molecular weight 277.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzhydryloxyethyl(methyl)azanium chloride
Also Known As: Monodesmethyldiphenhydramine, 2-benzhydryloxyethyl(methyl)azanium;chloride, beta-Methylaminoethyl benzhydryl ether hydrochloride, 2-benzhydryloxyethyl(methyl)azanium chloride, ETHYLAMINE, 2-(DIPHENYLMETHOXY)-N-METHYL-, HYDROCHLORIDE
| Molecular Formula | C16H20ClNO |
|---|---|
| Molecular Weight | 277.12 g/mol |
| LogP | -1.01 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.12335 |
| Heavy Atoms | 19 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 53499-40-4 |
|---|---|
| SMILES | C[NH2+]CCOC(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-] |
| InChIKey | OARUOQLHKTZEIM-UHFFFAOYSA-N |
Product Overview
beta-Methylaminoethyl benzhydryl ether hydrochloride (CAS 53499-40-4), with molecular formula C16H20ClNO and molecular weight 277.12 g/mol. IUPAC: 2-benzhydryloxyethyl(methyl)azanium chloride.
Chemical Property Profile of beta-Methylaminoethyl benzhydryl ether hydrochloride
Property Insights of beta-Methylaminoethyl benzhydryl ether hydrochloride
The XLogP value of -1.01 indicates that beta-Methylaminoethyl benzhydryl ether hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 25.8 Ų, beta-Methylaminoethyl benzhydryl ether hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Methylaminoethyl benzhydryl ether hydrochloride has 1 hydrogen bond donor(s) and 2 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 beta-Methylaminoethyl benzhydryl ether hydrochloride?
The CAS number of beta-Methylaminoethyl benzhydryl ether hydrochloride is 53499-40-4.
What is the molecular formula of beta-Methylaminoethyl benzhydryl ether hydrochloride?
The molecular formula of beta-Methylaminoethyl benzhydryl ether hydrochloride is C16H20ClNO.
What is the molecular weight of beta-Methylaminoethyl benzhydryl ether hydrochloride?
The molecular weight of beta-Methylaminoethyl benzhydryl ether hydrochloride is 277.12 g/mol.
Where can I buy beta-Methylaminoethyl benzhydryl ether hydrochloride?
You can request a quote for beta-Methylaminoethyl benzhydryl ether hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Methylaminoethyl benzhydryl ether hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for beta-Methylaminoethyl benzhydryl ether hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.