6-Tert-butyl-4,8-dimethylchromen-2-one
TL;DR: 6-Tert-butyl-4,8-dimethylchromen-2-one (CAS 17874-33-8) is a chemical compound with molecular formula C15H18O2 and molecular weight 230.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-4,8-dimethylchromen-2-one
Also Known As: 6-tert-butyl-4,8-dimethylchromen-2-one, 6-tert-butyl-4,8-dimethyl-2h-chromen-2-one, 4,8-DIMETHYL-6-TERT-BUTYL-CHROMEN-2-ONE, 6-tert-Butyl-4,8-dimethyl-2H-1-benzopyran-2-one, 2H-1-Benzopyran-2-one,6-(1,1-dimethylethyl)-4,8-dimethyl-
| Molecular Formula | C15H18O2 |
|---|---|
| Molecular Weight | 230.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.13068 |
| Heavy Atoms | 17 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 17874-33-8 |
|---|---|
| SMILES | CC1=CC(=CC2=C1OC(=O)C=C2C)C(C)(C)C |
| InChIKey | BQCUNTCSOSCBOV-UHFFFAOYSA-N |
Product Overview
6-Tert-butyl-4,8-dimethylchromen-2-one (CAS 17874-33-8), with molecular formula C15H18O2 and molecular weight 230.13 g/mol. IUPAC: 6-tert-butyl-4,8-dimethylchromen-2-one.
Chemical Property Profile of 6-Tert-butyl-4,8-dimethylchromen-2-one
Property Insights of 6-Tert-butyl-4,8-dimethylchromen-2-one
The XLogP value of 3.9 indicates that 6-Tert-butyl-4,8-dimethylchromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 6-Tert-butyl-4,8-dimethylchromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Tert-butyl-4,8-dimethylchromen-2-one has 0 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 6-Tert-butyl-4,8-dimethylchromen-2-one?
The CAS number of 6-Tert-butyl-4,8-dimethylchromen-2-one is 17874-33-8.
What is the molecular formula of 6-Tert-butyl-4,8-dimethylchromen-2-one?
The molecular formula of 6-Tert-butyl-4,8-dimethylchromen-2-one is C15H18O2.
What is the molecular weight of 6-Tert-butyl-4,8-dimethylchromen-2-one?
The molecular weight of 6-Tert-butyl-4,8-dimethylchromen-2-one is 230.13 g/mol.
Where can I buy 6-Tert-butyl-4,8-dimethylchromen-2-one?
You can request a quote for 6-Tert-butyl-4,8-dimethylchromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Tert-butyl-4,8-dimethylchromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Tert-butyl-4,8-dimethylchromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.