2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman
TL;DR: 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman (CAS 4072-32-6) is a chemical compound with molecular formula C16H22O4 and molecular weight 278.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(6-hydroxy-5,7,8-trimethyl-3,4-dihydro-2H-chromen-2-yl)propanoate
Also Known As: alpha-Cehc, Rac-(5-2H3)-alpha-CEHC, 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman, methyl 3-(6-hydroxy-5,7,8-trimethyl-3,4-dihydro-2H-chromen-2-yl)propanoate, METHYL 3-(6-HYDROXY-5,7,8-TRIMETHYL-CHROMAN-2-YL)PROPANOATE
| Molecular Formula | C16H22O4 |
|---|---|
| Molecular Weight | 278.15 g/mol |
| LogP | 2.96426 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.1518 |
| Heavy Atoms | 20 |
| Complexity | 534.0138 |
Chemical Identifiers
| CAS Number | 4072-32-6 |
|---|---|
| SMILES | CC1=C(C2=C(CCC(O2)CCC(=O)OC)C(=C1O)C)C |
Product Overview
2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman (CAS 4072-32-6), with molecular formula C16H22O4 and molecular weight 278.15 g/mol. IUPAC: methyl 3-(6-hydroxy-5,7,8-trimethyl-3,4-dihydro-2H-chromen-2-yl)propanoate.
Chemical Property Profile of 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman
Property Insights of 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman
The XLogP value of 2.96426 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman. With a topological polar surface area (TPSA) of 55.76 Ų, 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman has 1 hydrogen bond donor(s) and 4 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 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman?
The CAS number of 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman is 4072-32-6.
What is the molecular formula of 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman?
The molecular formula of 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman is C16H22O4.
What is the molecular weight of 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman?
The molecular weight of 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman is 278.15 g/mol.
Where can I buy 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman?
You can request a quote for 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman?
Yes, KEHONG BIO provides custom synthesis services for 2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.