2,2,5,7,8-Pentamethyl-6-chromanol
TL;DR: 2,2,5,7,8-Pentamethyl-6-chromanol (CAS 950-99-2) is a chemical compound with molecular formula C14H20O2 and molecular weight 220.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-ol
Also Known As: Chromanol, 2,2,5,7,8-Pentamethyl-6-chromanol, Chromane C1, Chroman C1, PMHCR
| Molecular Formula | C14H20O2 |
|---|---|
| Molecular Weight | 220.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.14633 |
| Heavy Atoms | 16 |
| Complexity | 261.0 |
| Melting Point | 94 °C |
Chemical Identifiers
| CAS Number | 950-99-2 |
|---|---|
| SMILES | CC1=C(C2=C(CCC(O2)(C)C)C(=C1O)C)C |
| InChIKey | SEBPXHSZHLFWRL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,5,7,8-Pentamethyl-6-chromanol (CAS 950-99-2), with molecular formula C14H20O2 and molecular weight 220.15 g/mol. IUPAC: 2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-ol.
Chemical Property Profile of 2,2,5,7,8-Pentamethyl-6-chromanol
Property Insights of 2,2,5,7,8-Pentamethyl-6-chromanol
The XLogP value of 3.6 indicates that 2,2,5,7,8-Pentamethyl-6-chromanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2,2,5,7,8-Pentamethyl-6-chromanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,5,7,8-Pentamethyl-6-chromanol has 1 hydrogen bond donor(s) and 2 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 2,2,5,7,8-Pentamethyl-6-chromanol?
The CAS number of 2,2,5,7,8-Pentamethyl-6-chromanol is 950-99-2.
What is the molecular formula of 2,2,5,7,8-Pentamethyl-6-chromanol?
The molecular formula of 2,2,5,7,8-Pentamethyl-6-chromanol is C14H20O2.
What is the molecular weight of 2,2,5,7,8-Pentamethyl-6-chromanol?
The molecular weight of 2,2,5,7,8-Pentamethyl-6-chromanol is 220.15 g/mol.
Where can I buy 2,2,5,7,8-Pentamethyl-6-chromanol?
You can request a quote for 2,2,5,7,8-Pentamethyl-6-chromanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,5,7,8-Pentamethyl-6-chromanol?
Yes, KEHONG BIO provides custom synthesis services for 2,2,5,7,8-Pentamethyl-6-chromanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.