1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-
TL;DR: 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- (CAS 71906-48-4) is a chemical compound with molecular formula C13H11NO and molecular weight 197.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxytricyclo[6.2.1.02,7]undeca-2(7),3,5,9-tetraene-9-carbonitrile
Also Known As: RCL T201065, 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-, 1,4-Methanonaphthalene-2-carbonitrile,1,4-dihydro-8-methoxy-, 8-Methoxy-1,4-dihydro-1,4-methanonaphthalene-2-carbonitrile
| Molecular Formula | C13H11NO |
|---|---|
| Molecular Weight | 197.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.08406 |
| Heavy Atoms | 15 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 71906-48-4 |
|---|---|
| SMILES | COC1=CC=CC2=C1C3CC2C=C3C#N |
| InChIKey | NMBDJHWLMRYGKJ-UHFFFAOYSA-N |
Product Overview
1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- (CAS 71906-48-4), with molecular formula C13H11NO and molecular weight 197.08 g/mol. IUPAC: 6-methoxytricyclo[6.2.1.02,7]undeca-2(7),3,5,9-tetraene-9-carbonitrile.
Chemical Property Profile of 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-
Property Insights of 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-. With a topological polar surface area (TPSA) of 33.0 Ų, 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- 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 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-?
The CAS number of 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- is 71906-48-4.
What is the molecular formula of 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-?
The molecular formula of 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- is C13H11NO.
What is the molecular weight of 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-?
The molecular weight of 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- is 197.08 g/mol.
Where can I buy 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-?
You can request a quote for 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-8-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.