Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-
TL;DR: Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- (CAS 51290-65-4) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-tert-butylphenyl)butan-2-ol
Also Known As: 4-(4-tert-butylphenyl)butan-2-ol, 4- butan-2-ol, 4-(p-tert-Butylphenyl)butan-2-ol, p-tert-Butyl-alpha-methylhydrocinnamic alcohol, Benzenepropanol, 4-(1,1-dimethylethyl)-.alpha.-methyl-
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 51290-65-4 |
|---|---|
| SMILES | CC(CCC1=CC=C(C=C1)C(C)(C)C)O |
| InChIKey | OATMQLUGSMOYRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- (CAS 51290-65-4), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: 4-(4-tert-butylphenyl)butan-2-ol.
Chemical Property Profile of Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-
Property Insights of Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-
The XLogP value of 4.0 indicates that Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- 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 Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-?
The CAS number of Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- is 51290-65-4.
What is the molecular formula of Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-?
The molecular formula of Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- is C14H22O.
What is the molecular weight of Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-?
The molecular weight of Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- is 206.17 g/mol.
Where can I buy Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-?
You can request a quote for Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenepropanol, 4-(1,1-dimethylethyl)-alpha-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.