alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol
TL;DR: alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol (CAS 33446-27-4) is a chemical compound with molecular formula C12H16O and molecular weight 176.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclopropyl-1-(4-methylphenyl)ethanol
Also Known As: Ethanol, dl-, 1-Cyclopropyl-1-(p-tolyl)ethanol, 1-cyclopropyl-1-(4-methylphenyl)ethanol, dl-Cyclopropyl methyl p-tolyl carbinol, dl-1-Cyclopropyl-1-(p-tolyl)ethanol
| Molecular Formula | C12H16O |
|---|---|
| Molecular Weight | 176.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.12012 |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 33446-27-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C)(C2CC2)O |
| InChIKey | IJYCFWNBUFSFNP-UHFFFAOYSA-N |
Product Overview
alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol (CAS 33446-27-4), with molecular formula C12H16O and molecular weight 176.12 g/mol. IUPAC: 1-cyclopropyl-1-(4-methylphenyl)ethanol.
Chemical Property Profile of alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol
Property Insights of alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol. With a topological polar surface area (TPSA) of 20.2 Ų, alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol 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-Cyclopropyl-alpha,4-dimethylbenzenemethanol?
The CAS number of alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol is 33446-27-4.
What is the molecular formula of alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol?
The molecular formula of alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol is C12H16O.
What is the molecular weight of alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol?
The molecular weight of alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol is 176.12 g/mol.
Where can I buy alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol?
You can request a quote for alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for alpha-Cyclopropyl-alpha,4-dimethylbenzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.