Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-
TL;DR: Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- (CAS 4237-73-4) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxy-3-methylbutyl)phenol
Also Known As: Hydroxyamylphenol, 4-(3-hydroxy-3-methylbutyl)phenol, Benzenepropanol,.alpha.-dimethyl-, Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-, Benzenepropanol, 4-hydroxy-.alpha.,.alpha.-dimethyl-
| Molecular Formula | C11H16O2 |
|---|---|
| Molecular Weight | 180.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.11504 |
| Heavy Atoms | 13 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 4237-73-4 |
|---|---|
| SMILES | CC(C)(CCC1=CC=C(C=C1)O)O |
| InChIKey | BGHHDJUQYBAXSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- (CAS 4237-73-4), with molecular formula C11H16O2 and molecular weight 180.12 g/mol. IUPAC: 4-(3-hydroxy-3-methylbutyl)phenol.
Chemical Property Profile of Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-
Property Insights of Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-. With a topological polar surface area (TPSA) of 40.5 Ų, Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- 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 Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-?
The CAS number of Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- is 4237-73-4.
What is the molecular formula of Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-?
The molecular formula of Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- is C11H16O2.
What is the molecular weight of Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-?
The molecular weight of Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- is 180.12 g/mol.
Where can I buy Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-?
You can request a quote for Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenepropanol, 4-hydroxy-alpha,alpha-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.