6-Methoxy-7h-benzocyclohepten-7-one
TL;DR: 6-Methoxy-7h-benzocyclohepten-7-one (CAS 6322-85-6) is a chemical compound with molecular formula C12H10O2 and molecular weight 186.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxybenzo[7]annulen-7-one
Also Known As: 6-methoxy-7h-benzocyclohepten-7-one, 6-methoxybenzo[7]annulen-7-one, 6-Methoxy-7H-benzo[7]annulen-7-one, 8-methoxy-benzo[7]annulen-7-one, 6-Methoxy-7H-benzocyclohepten-7-on
| Molecular Formula | C12H10O2 |
|---|---|
| Molecular Weight | 186.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.06808 |
| Heavy Atoms | 14 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 6322-85-6 |
|---|---|
| SMILES | COC1=CC2=CC=CC=C2C=CC1=O |
| InChIKey | IHTNPICSPHFGNZ-UHFFFAOYSA-N |
Product Overview
6-Methoxy-7h-benzocyclohepten-7-one (CAS 6322-85-6), with molecular formula C12H10O2 and molecular weight 186.07 g/mol. IUPAC: 6-methoxybenzo[7]annulen-7-one.
Chemical Property Profile of 6-Methoxy-7h-benzocyclohepten-7-one
Property Insights of 6-Methoxy-7h-benzocyclohepten-7-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-7h-benzocyclohepten-7-one. With a topological polar surface area (TPSA) of 26.3 Ų, 6-Methoxy-7h-benzocyclohepten-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxy-7h-benzocyclohepten-7-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-Methoxy-7h-benzocyclohepten-7-one?
The CAS number of 6-Methoxy-7h-benzocyclohepten-7-one is 6322-85-6.
What is the molecular formula of 6-Methoxy-7h-benzocyclohepten-7-one?
The molecular formula of 6-Methoxy-7h-benzocyclohepten-7-one is C12H10O2.
What is the molecular weight of 6-Methoxy-7h-benzocyclohepten-7-one?
The molecular weight of 6-Methoxy-7h-benzocyclohepten-7-one is 186.07 g/mol.
Where can I buy 6-Methoxy-7h-benzocyclohepten-7-one?
You can request a quote for 6-Methoxy-7h-benzocyclohepten-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-7h-benzocyclohepten-7-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-7h-benzocyclohepten-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.