N-苄基-4-羟基苯胺氯化物
TL;DR: N-苄基-4-羟基苯胺氯化物 (CAS 621-92-1) is a chemical compound with molecular formula C13H14ClNO and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苄基-4-羟基苯胺氯化物
benzyl-(4-hydroxyphenyl)azanium chloride
Also Known As: N-Benzyl-4-hydroxyanilinium chloride, Monobenzyl-p-aminophenol hydrochloride, Phenol, p-(benzylamino)-, hydrochloride, benzyl-(4-hydroxyphenyl)azanium chloride, Phenol, 4-((phenylmethyl)amino)-, hydrochloride
| Molecular Formula | C13H14ClNO |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | -1.21 |
| Topological Polar Surface Area | 36.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.07639 |
| Heavy Atoms | 16 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 621-92-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[NH2+]C2=CC=C(C=C2)O.[Cl-] |
| InChIKey | JBXHUWBBVGSDJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-苄基-4-羟基苯胺氯化物 (CAS 621-92-1), with molecular formula C13H14ClNO and molecular weight 235.08 g/mol. IUPAC: benzyl-(4-hydroxyphenyl)azanium chloride.
Chemical Property Profile of N-苄基-4-羟基苯胺氯化物
Property Insights of N-苄基-4-羟基苯胺氯化物
The XLogP value of -1.21 indicates that N-苄基-4-羟基苯胺氯化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.8 Ų, N-苄基-4-羟基苯胺氯化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-苄基-4-羟基苯胺氯化物 has 2 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 N-苄基-4-羟基苯胺氯化物?
The CAS number of N-苄基-4-羟基苯胺氯化物 is 621-92-1.
What is the molecular formula of N-苄基-4-羟基苯胺氯化物?
The molecular formula of N-苄基-4-羟基苯胺氯化物 is C13H14ClNO.
What is the molecular weight of N-苄基-4-羟基苯胺氯化物?
The molecular weight of N-苄基-4-羟基苯胺氯化物 is 235.08 g/mol.
Where can I buy N-苄基-4-羟基苯胺氯化物?
You can request a quote for N-苄基-4-羟基苯胺氯化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-苄基-4-羟基苯胺氯化物?
Yes, KEHONG BIO provides custom synthesis services for N-苄基-4-羟基苯胺氯化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.