1,2-Benzocyclononen-3-ol
TL;DR: 1,2-Benzocyclononen-3-ol (CAS 1276541-94-6) is a chemical compound with molecular formula C13H18O and molecular weight 190.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R)-6,7,8,9,10,11-hexahydro-5H-benzo[9]annulen-6-ol
Also Known As: 1,2-Benzocyclononen-3-ol, (6R)-6,7,8,9,10,11-hexahydro-5H-benzo[9]annulen-6-ol, 1H-?Pyrazole-?3-?carboxamide, 5-?(trifluoromethyl)?-, 5H-Benzocyclononen-5-ol, 6,7,8,9,10,11-hexahydro-, (S)-
Technical Specifications
| Molecular Formula | C13H18O |
| Molecular Weight | 190.13577 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.13577 Da |
| Heavy Atoms | 14 |
| Complexity | 167.0 |
| SMILES | C1CC[C@H](CC2=CC=CC=C2CC1)O |
| InChIKey | CMTVEFDHBHPPAB-CYBMUJFWSA-N |
Chemical Property Profile of 1,2-Benzocyclononen-3-ol
Property Insights of 1,2-Benzocyclononen-3-ol
The XLogP value of 3.4 indicates that 1,2-Benzocyclononen-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 1,2-Benzocyclononen-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Benzocyclononen-3-ol has 1 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 1,2-Benzocyclononen-3-ol?
The CAS number of 1,2-Benzocyclononen-3-ol is 1276541-94-6.
What is the molecular formula of 1,2-Benzocyclononen-3-ol?
The molecular formula of 1,2-Benzocyclononen-3-ol is C13H18O.
What is the molecular weight of 1,2-Benzocyclononen-3-ol?
The molecular weight of 1,2-Benzocyclononen-3-ol is 190.13577 g/mol.
Where can I buy 1,2-Benzocyclononen-3-ol?
You can request a quote for 1,2-Benzocyclononen-3-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2-Benzocyclononen-3-ol?
Yes, CoreyChem provides custom synthesis services for 1,2-Benzocyclononen-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.