5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-
TL;DR: 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- (CAS 33655-73-1) is a chemical compound with molecular formula C13H9ClO and molecular weight 216.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chlorotricyclo[6.4.1.02,7]trideca-2,4,6,9,11-pentaen-13-one
Also Known As: 5-Chloro-5,10-dihydro-5,10-methanobenzocycloocten-11-one, 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-, 1-chlorotricyclo[6.4.1.02,7]trideca-2,4,6,9,11-pentaen-13-one
| Molecular Formula | C13H9ClO |
|---|---|
| Molecular Weight | 216.03 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.0342 |
| Heavy Atoms | 15 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 33655-73-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3C=CC=CC2(C3=O)Cl |
| InChIKey | GLLZHHSREZXUBG-UHFFFAOYSA-N |
Product Overview
5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- (CAS 33655-73-1), with molecular formula C13H9ClO and molecular weight 216.03 g/mol. IUPAC: 1-chlorotricyclo[6.4.1.02,7]trideca-2,4,6,9,11-pentaen-13-one.
Chemical Property Profile of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-
Property Insights of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-
The XLogP value of 3.2 indicates that 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- 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
Frequently Asked Questions
What is the CAS number of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-?
The CAS number of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- is 33655-73-1.
What is the molecular formula of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-?
The molecular formula of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- is C13H9ClO.
What is the molecular weight of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-?
The molecular weight of 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- is 216.03 g/mol.
Where can I buy 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-?
You can request a quote for 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 5,10-Methanobenzocycloocten-11-one, 5-chloro-5,10-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.