alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol
TL;DR: alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol (CAS 14860-89-0) is a chemical compound with molecular formula C12H18O and molecular weight 178.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-propan-2-ylphenyl)propan-2-ol
Also Known As: m-Hydroxydiisopropylbenzene, m-Oxidiisopropylbenzene, 2-(3-iso-Propylphenyl)-2-propanol, isopropylbenzene monocarbinol, 2-[3-(propan-2-yl)phenyl]propan-2-ol
| Molecular Formula | C12H18O |
|---|---|
| Molecular Weight | 178.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.13577 |
| Heavy Atoms | 13 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 14860-89-0 |
|---|---|
| SMILES | CC(C)C1=CC(=CC=C1)C(C)(C)O |
| InChIKey | GCFSLINNKUVOJH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol (CAS 14860-89-0), with molecular formula C12H18O and molecular weight 178.14 g/mol. IUPAC: 2-(3-propan-2-ylphenyl)propan-2-ol.
Chemical Property Profile of alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol
Property Insights of alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol. With a topological polar surface area (TPSA) of 20.2 Ų, alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol 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 alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol?
The CAS number of alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol is 14860-89-0.
What is the molecular formula of alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol?
The molecular formula of alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol is C12H18O.
What is the molecular weight of alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol?
The molecular weight of alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol is 178.14 g/mol.
Where can I buy alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol?
You can request a quote for alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for alpha,alpha-Dimethyl-3-(1-methylethyl)benzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.