2-sec-Butylphenol
TL;DR: 2-sec-Butylphenol (CAS 89-72-5) is a chemical compound with molecular formula C10H14O and molecular weight 150.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butan-2-ylphenol
Also Known As: 2-sec-Butylphenol, o-sec-Butylphenol, 2-(butan-2-yl)phenol, 2-(2-Butyl)phenol, 2-butan-2-ylphenol
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H14O |
| Molecular Weight | 150.10446 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.10446 Da |
| Heavy Atoms | 11 |
| Complexity | 111.0 |
| Melting Point | 54 °F (NTP, 1992) |
| Boiling Point | 439 to 442 °F at 760 mmHg (NTP, 1992) |
| Density | 0.981 at 77 °F (NTP, 1992) - Less dense than water; will float |
| Flash Point | 234 °F (NTP, 1992) |
| Vapor Pressure | Low (NIOSH, 2024) |
| Refractive Index | Index of refraction = 1.5182 @ 21 °C |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| SMILES | CCC(C)C1=CC=CC=C1O |
| InChIKey | NGFPWHGISWUQOI-UHFFFAOYSA-N |
Product Description
Applications: 2-sec-Butylphenol is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2-sec-Butylphenol is a organic building block identified by CAS number 89-72-5 and the molecular formula C10H14O and a molecular weight of 150.1 g/mol. Physically, the compound has a density of 0.981 at 77 °F (NTP, 1992) - Less dense than water; will float g/cm³, a solubility: less than 1 mg/mL at 68 °F (NTP, 1992). Synonyms include 2-sec-Butylphenol and o-sec-Butylphenol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-sec-Butylphenol
Property Insights of 2-sec-Butylphenol
The XLogP value of 3.4 indicates that 2-sec-Butylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-sec-Butylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-sec-Butylphenol 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
What is the CAS number of 2-sec-Butylphenol?
The CAS number of 2-sec-Butylphenol is 89-72-5.
What is the molecular formula of 2-sec-Butylphenol?
The molecular formula of 2-sec-Butylphenol is C10H14O.
What is the molecular weight of 2-sec-Butylphenol?
The molecular weight of 2-sec-Butylphenol is 150.10446 g/mol.
What are the applications of 2-sec-Butylphenol?
2-sec-Butylphenol is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 2-sec-Butylphenol?
You can request a quote for 2-sec-Butylphenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-sec-Butylphenol?
Yes, CoreyChem provides custom synthesis services for 2-sec-Butylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.