4,4-Dimethyl-1-phenylpentan-2-ol
TL;DR: 4,4-Dimethyl-1-phenylpentan-2-ol (CAS 40541-10-4) is a chemical compound with molecular formula C13H20O and molecular weight 192.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-1-phenylpentan-2-ol
Also Known As: 4,4-dimethyl-1-phenylpentan-2-ol, BENZENEETHANOL, A-(2,2-DIMETHYLPROPYL)-
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 40541-10-4 |
|---|---|
| SMILES | CC(C)(C)CC(CC1=CC=CC=C1)O |
| InChIKey | MBRZYUHBFJXHNF-UHFFFAOYSA-N |
Product Overview
4,4-Dimethyl-1-phenylpentan-2-ol (CAS 40541-10-4), with molecular formula C13H20O and molecular weight 192.15 g/mol. IUPAC: 4,4-dimethyl-1-phenylpentan-2-ol.
Chemical Property Profile of 4,4-Dimethyl-1-phenylpentan-2-ol
Property Insights of 4,4-Dimethyl-1-phenylpentan-2-ol
The XLogP value of 3.7 indicates that 4,4-Dimethyl-1-phenylpentan-2-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4,4-Dimethyl-1-phenylpentan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-1-phenylpentan-2-ol 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 4,4-Dimethyl-1-phenylpentan-2-ol?
The CAS number of 4,4-Dimethyl-1-phenylpentan-2-ol is 40541-10-4.
What is the molecular formula of 4,4-Dimethyl-1-phenylpentan-2-ol?
The molecular formula of 4,4-Dimethyl-1-phenylpentan-2-ol is C13H20O.
What is the molecular weight of 4,4-Dimethyl-1-phenylpentan-2-ol?
The molecular weight of 4,4-Dimethyl-1-phenylpentan-2-ol is 192.15 g/mol.
Where can I buy 4,4-Dimethyl-1-phenylpentan-2-ol?
You can request a quote for 4,4-Dimethyl-1-phenylpentan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethyl-1-phenylpentan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethyl-1-phenylpentan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.