2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
TL;DR: 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one (CAS 36255-58-0) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3-methoxy-6,6-dimethyl-8,9-dihydro-7H-benzo[7]annulen-5-one
Also Known As: 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one, 2-hydroxy-3-methoxy-6,6-dimethyl-8,9-dihydro-7H-benzo[7]annu, 2-hydroxy-3-methoxy-6,6-dimethyl-8,9-dihydro-7H-benzo[7]annulen-5-one
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 36255-58-0 |
|---|---|
| SMILES | CC1(CCCC2=CC(=C(C=C2C1=O)OC)O)C |
| InChIKey | IVWAZOZQDTXDOH-UHFFFAOYSA-N |
Product Overview
2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one (CAS 36255-58-0), with molecular formula C14H18O3 and molecular weight 234.13 g/mol. IUPAC: 2-hydroxy-3-methoxy-6,6-dimethyl-8,9-dihydro-7H-benzo[7]annulen-5-one.
Chemical Property Profile of 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
Property Insights of 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
The XLogP value of 3.1 indicates that 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one has 1 hydrogen bond donor(s) and 3 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-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
The CAS number of 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one is 36255-58-0.
What is the molecular formula of 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
The molecular formula of 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one is C14H18O3.
What is the molecular weight of 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
The molecular weight of 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one is 234.13 g/mol.
Where can I buy 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
You can request a quote for 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-3-methoxy-6,6-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.