3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran
TL;DR: 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran (CAS 17937-03-0) is a chemical compound with molecular formula C12H16O and molecular weight 176.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,4-trimethyl-3,4-dihydrochromene
Also Known As: 2,2,4-trimethylchromane, 2,2,4-trimethylchroman, 2,2,4-trimethyl-3,4-dihydrochromene, 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran, 2,2,4-Trimethyl-3,4-dihydro-2H-1-benzopyran
Technical Specifications
| Molecular Formula | C12H16O |
| Molecular Weight | 176.12012 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.12012 Da |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
| SMILES | CC1CC(OC2=CC=CC=C12)(C)C |
| InChIKey | RZWKXCCZVCZJOU-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran
Property Insights of 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran
The XLogP value of 3.2 indicates that 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran has 0 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 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran?
The CAS number of 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran is 17937-03-0.
What is the molecular formula of 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran?
The molecular formula of 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran is C12H16O.
What is the molecular weight of 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran?
The molecular weight of 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran is 176.12012 g/mol.
Where can I buy 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran?
You can request a quote for 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran?
Yes, CoreyChem provides custom synthesis services for 3,4-Dihydro-2,2,4-trimethyl2H-1-benzopyran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.