9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile
TL;DR: 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile (CAS 6965-02-2) is a chemical compound with molecular formula C17H13N and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15-carbonitrile
Also Known As: 9,10-dihydro-9,10-ethanoanthracene-11-carbonitrile, 11-cyano-9,10-dihydro-9,10-ethanoanthracene, 11-cyano-9,10-dihydro-9,10-ethano-anthracene, tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15-carbonitrile, 11-CYANOMETHYL-9,10-DIHYDRO-9,10-ETHANOANTHRACENE
| Molecular Formula | C17H13N |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 231.1048 |
| Heavy Atoms | 18 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 6965-02-2 |
|---|---|
| SMILES | C1C(C2C3=CC=CC=C3C1C4=CC=CC=C24)C#N |
| InChIKey | XPVVUQSODGYUPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile (CAS 6965-02-2), with molecular formula C17H13N and molecular weight 231.10 g/mol. IUPAC: tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15-carbonitrile.
Chemical Property Profile of 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile
Property Insights of 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile
The XLogP value of 3.3 indicates that 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile 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 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile?
The CAS number of 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile is 6965-02-2.
What is the molecular formula of 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile?
The molecular formula of 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile is C17H13N.
What is the molecular weight of 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile?
The molecular weight of 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile is 231.10 g/mol.
Where can I buy 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile?
You can request a quote for 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Dihydro-9,10-ethanoanthracene-11-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.