2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman
TL;DR: 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman (CAS 178167-77-6) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6-hydroxy-2,7,8-trimethyl-3,4-dihydrochromen-2-yl)propanoic acid
Also Known As: Gamma-CEHC, Llu-alpha, S-Llu-alpha, Gamma_CECH, A-CEHC
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 178167-77-6 |
|---|---|
| SMILES | CC1=C(C=C2CCC(OC2=C1C)(C)CCC(=O)O)O |
| InChIKey | VMJQLPNCUPGMNQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman (CAS 178167-77-6), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: 3-(6-hydroxy-2,7,8-trimethyl-3,4-dihydrochromen-2-yl)propanoic acid.
Chemical Property Profile of 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman
Property Insights of 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman. Following Lipinski's Rule of Five, 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman has 2 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 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman?
The CAS number of 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman is 178167-77-6.
What is the molecular formula of 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman?
The molecular formula of 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman is C15H20O4.
What is the molecular weight of 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman?
The molecular weight of 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman is 264.14 g/mol.
Where can I buy 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman?
You can request a quote for 2,7,8-Trimethyl-2-(beta-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 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman?
Yes, KEHONG BIO provides custom synthesis services for 2,7,8-Trimethyl-2-(beta-carboxyethyl)-6-hydroxychroman and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.