1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol
TL;DR: 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol (CAS 64025-05-4) is a chemical compound with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(tert-butylamino)-1-hydroxyethyl]-3-chlorophenol
Also Known As: Hoku 81, Meluadrine, 4-Hydroxytulobuterol, 1- -tert-butylaminoethanol, 2-tert-butyl-9-fluorenone
| Molecular Formula | C12H18ClNO2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 52.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.1026 |
| Heavy Atoms | 16 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 64025-05-4 |
|---|---|
| SMILES | CC(C)(C)NCC(C1=C(C=C(C=C1)O)Cl)O |
| InChIKey | LIXBJWRFCNRAPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol (CAS 64025-05-4), with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol. IUPAC: 4-[2-(tert-butylamino)-1-hydroxyethyl]-3-chlorophenol.
Chemical Property Profile of 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol
Property Insights of 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol. With a topological polar surface area (TPSA) of 52.5 Ų, 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol has 3 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 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol?
The CAS number of 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol is 64025-05-4.
What is the molecular formula of 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol?
The molecular formula of 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol is C12H18ClNO2.
What is the molecular weight of 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol?
The molecular weight of 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol is 243.10 g/mol.
Where can I buy 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol?
You can request a quote for 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloro-4-hydroxyphenyl)-tert-butylaminoethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.