2H-1,4-Ethanoquinoline, 3,4-dihydro-
TL;DR: 2H-1,4-Ethanoquinoline, 3,4-dihydro- (CAS 4363-25-1) is a chemical compound with molecular formula C11H13N and molecular weight 159.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azatricyclo[6.2.2.02,7]dodeca-2,4,6-triene
Also Known As: Benzoquinuclidine, benzo[b]quinuclidine, 2H-1,4-Ethanoquinoline, 3,4-dihydro-, 3,4-Dihydro-2H-1,4-ethanoquinoline, 1,4-Dihydro-1,4-Ethanoquinoline
| Molecular Formula | C11H13N |
|---|---|
| Molecular Weight | 159.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.1048 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 4363-25-1 |
|---|---|
| SMILES | C1CN2CCC1C3=CC=CC=C32 |
| InChIKey | RNFRFPSSWGWDKI-UHFFFAOYSA-N |
Product Overview
2H-1,4-Ethanoquinoline, 3,4-dihydro- (CAS 4363-25-1), with molecular formula C11H13N and molecular weight 159.10 g/mol. IUPAC: 1-azatricyclo[6.2.2.02,7]dodeca-2,4,6-triene.
Chemical Property Profile of 2H-1,4-Ethanoquinoline, 3,4-dihydro-
Property Insights of 2H-1,4-Ethanoquinoline, 3,4-dihydro-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,4-Ethanoquinoline, 3,4-dihydro-. With a topological polar surface area (TPSA) of 3.2 Ų, 2H-1,4-Ethanoquinoline, 3,4-dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,4-Ethanoquinoline, 3,4-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 2H-1,4-Ethanoquinoline, 3,4-dihydro-?
The CAS number of 2H-1,4-Ethanoquinoline, 3,4-dihydro- is 4363-25-1.
What is the molecular formula of 2H-1,4-Ethanoquinoline, 3,4-dihydro-?
The molecular formula of 2H-1,4-Ethanoquinoline, 3,4-dihydro- is C11H13N.
What is the molecular weight of 2H-1,4-Ethanoquinoline, 3,4-dihydro-?
The molecular weight of 2H-1,4-Ethanoquinoline, 3,4-dihydro- is 159.10 g/mol.
Where can I buy 2H-1,4-Ethanoquinoline, 3,4-dihydro-?
You can request a quote for 2H-1,4-Ethanoquinoline, 3,4-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,4-Ethanoquinoline, 3,4-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,4-Ethanoquinoline, 3,4-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.