4-Chloro-alpha-ethylbenzenemethanol
TL;DR: 4-Chloro-alpha-ethylbenzenemethanol (CAS 13856-85-4) is a chemical compound with molecular formula C9H11ClO and molecular weight 170.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)propan-1-ol
Also Known As: 1-(4-chlorophenyl)propan-1-ol, 4-Chloro-alpha-ethylbenzyl alcohol, (4-chlorophenyl)propanol, 4-Chloro-a-ethyl-benzenemethanol, 4-Chloro-alpha-ethylbenzenemethanol
| Molecular Formula | C9H11ClO |
|---|---|
| Molecular Weight | 170.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.04984 |
| Heavy Atoms | 11 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 13856-85-4 |
|---|---|
| SMILES | CCC(C1=CC=C(C=C1)Cl)O |
| InChIKey | TXAWBKBMGZKBNN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-alpha-ethylbenzenemethanol (CAS 13856-85-4), with molecular formula C9H11ClO and molecular weight 170.05 g/mol. IUPAC: 1-(4-chlorophenyl)propan-1-ol.
Chemical Property Profile of 4-Chloro-alpha-ethylbenzenemethanol
Property Insights of 4-Chloro-alpha-ethylbenzenemethanol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-alpha-ethylbenzenemethanol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Chloro-alpha-ethylbenzenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-alpha-ethylbenzenemethanol has 1 hydrogen bond donor(s) and 1 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 4-Chloro-alpha-ethylbenzenemethanol?
The CAS number of 4-Chloro-alpha-ethylbenzenemethanol is 13856-85-4.
What is the molecular formula of 4-Chloro-alpha-ethylbenzenemethanol?
The molecular formula of 4-Chloro-alpha-ethylbenzenemethanol is C9H11ClO.
What is the molecular weight of 4-Chloro-alpha-ethylbenzenemethanol?
The molecular weight of 4-Chloro-alpha-ethylbenzenemethanol is 170.05 g/mol.
Where can I buy 4-Chloro-alpha-ethylbenzenemethanol?
You can request a quote for 4-Chloro-alpha-ethylbenzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-alpha-ethylbenzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-alpha-ethylbenzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.