Ethanol, 2-anilino-, hydrochloride
TL;DR: Ethanol, 2-anilino-, hydrochloride (CAS 53676-26-9) is a chemical compound with molecular formula C8H12ClNO and molecular weight 173.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-anilinoethanol;hydrochloride
Also Known As: 2-Anilinoethanol, hydrochloride, Ethanol, 2-anilino-, hydrochloride, 2-anilinoethanol,hydrochloride, N-Phenylethanolamine, hydrochloride, 2-(Phenylamino)ethanol, hydrochloride
| Molecular Formula | C8H12ClNO |
|---|---|
| Molecular Weight | 173.06 g/mol |
| LogP | 1.5126 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 173.06075 |
| Heavy Atoms | 11 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 53676-26-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)NCCO.Cl |
| InChIKey | PQLXJCRFZCRBNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanol, 2-anilino-, hydrochloride (CAS 53676-26-9), with molecular formula C8H12ClNO and molecular weight 173.06 g/mol. IUPAC: 2-anilinoethanol;hydrochloride.
Chemical Property Profile of Ethanol, 2-anilino-, hydrochloride
Property Insights of Ethanol, 2-anilino-, hydrochloride
The XLogP value of 1.5126 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol, 2-anilino-, hydrochloride. With a topological polar surface area (TPSA) of 32.3 Ų, Ethanol, 2-anilino-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 2-anilino-, hydrochloride has 3 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 Ethanol, 2-anilino-, hydrochloride?
The CAS number of Ethanol, 2-anilino-, hydrochloride is 53676-26-9.
What is the molecular formula of Ethanol, 2-anilino-, hydrochloride?
The molecular formula of Ethanol, 2-anilino-, hydrochloride is C8H12ClNO.
What is the molecular weight of Ethanol, 2-anilino-, hydrochloride?
The molecular weight of Ethanol, 2-anilino-, hydrochloride is 173.06 g/mol.
Where can I buy Ethanol, 2-anilino-, hydrochloride?
You can request a quote for Ethanol, 2-anilino-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2-anilino-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2-anilino-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.