2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-
TL;DR: 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- (CAS 6344-57-6) is a chemical compound with molecular formula C16H22O2 and molecular weight 246.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-7-pentylchromen-5-ol
Also Known As: 2,2-dimethyl-7-pentylchromen-5-ol, 2,2-dimethyl-7-pentyl-chromen-5-ol, 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-, 2,2-dimethyl-7-pentyl-2H-chromen-5-ol, 5-Hydroxy-2,2-dimethyl-7-n-pentylchromene
| Molecular Formula | C16H22O2 |
|---|---|
| Molecular Weight | 246.16 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.16199 |
| Heavy Atoms | 18 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 6344-57-6 |
|---|---|
| SMILES | CCCCCC1=CC(=C2C=CC(OC2=C1)(C)C)O |
| InChIKey | XLSYFQOJMWXOCT-UHFFFAOYSA-N |
Product Overview
2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- (CAS 6344-57-6), with molecular formula C16H22O2 and molecular weight 246.16 g/mol. IUPAC: 2,2-dimethyl-7-pentylchromen-5-ol.
Chemical Property Profile of 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-
Property Insights of 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-
The XLogP value of 4.9 indicates that 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- 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 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-?
The CAS number of 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- is 6344-57-6.
What is the molecular formula of 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-?
The molecular formula of 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- is C16H22O2.
What is the molecular weight of 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-?
The molecular weight of 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- is 246.16 g/mol.
Where can I buy 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-?
You can request a quote for 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-5-ol, 2,2-dimethyl-7-pentyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.