Phenol, 4-methyl-2-(1-methyl-2-butenyl)-
TL;DR: Phenol, 4-methyl-2-(1-methyl-2-butenyl)- (CAS 13831-49-7) 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.
4-methyl-2-pent-3-en-2-ylphenol
Also Known As: 4-methyl-2-pent-3-en-2-ylphenol, Phenol, 4-methyl-2-(1-methyl-2-butenyl)-, 2-(1-methyl-2-butenyl)-p-cresol, 2-(1-methyl-2-butenyl)-4-methylphenol, Phenol, 2-(2-penten-4-yl)-4-methyl-
| Molecular Formula | C12H16O |
|---|---|
| Molecular Weight | 176.12 g/mol |
| LogP | 3.6 |
| 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 | 174.0 |
Chemical Identifiers
| CAS Number | 13831-49-7 |
|---|---|
| SMILES | CC=CC(C)C1=C(C=CC(=C1)C)O |
| InChIKey | REEVSMMNDPUOFK-UHFFFAOYSA-N |
Product Overview
Phenol, 4-methyl-2-(1-methyl-2-butenyl)- (CAS 13831-49-7), with molecular formula C12H16O and molecular weight 176.12 g/mol. IUPAC: 4-methyl-2-pent-3-en-2-ylphenol.
Chemical Property Profile of Phenol, 4-methyl-2-(1-methyl-2-butenyl)-
Property Insights of Phenol, 4-methyl-2-(1-methyl-2-butenyl)-
The XLogP value of 3.6 indicates that Phenol, 4-methyl-2-(1-methyl-2-butenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Phenol, 4-methyl-2-(1-methyl-2-butenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 4-methyl-2-(1-methyl-2-butenyl)- 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 Phenol, 4-methyl-2-(1-methyl-2-butenyl)-?
The CAS number of Phenol, 4-methyl-2-(1-methyl-2-butenyl)- is 13831-49-7.
What is the molecular formula of Phenol, 4-methyl-2-(1-methyl-2-butenyl)-?
The molecular formula of Phenol, 4-methyl-2-(1-methyl-2-butenyl)- is C12H16O.
What is the molecular weight of Phenol, 4-methyl-2-(1-methyl-2-butenyl)-?
The molecular weight of Phenol, 4-methyl-2-(1-methyl-2-butenyl)- is 176.12 g/mol.
Where can I buy Phenol, 4-methyl-2-(1-methyl-2-butenyl)-?
You can request a quote for Phenol, 4-methyl-2-(1-methyl-2-butenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-methyl-2-(1-methyl-2-butenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-methyl-2-(1-methyl-2-butenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.