1,2,3,4-Tetrahydro-1-isocyanonaphthalene
TL;DR: 1,2,3,4-Tetrahydro-1-isocyanonaphthalene (CAS 602262-90-8) is a chemical compound with molecular formula C11H11N and molecular weight 157.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-isocyano-1,2,3,4-tetrahydronaphthalene
Also Known As: 1-isocyanotetralin, 2-Isocyanotetralin, 1-isocyano-1,2,3,4-tetrahydronaphthalene, isocyanotetrahydronaphthalene, 1,2,3,4-tetrahydronaphthalen-1-yl isocyanide
| Molecular Formula | C11H11N |
|---|---|
| Molecular Weight | 157.09 g/mol |
| LogP | 2.98329 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.08914 |
| Heavy Atoms | 12 |
| Complexity | 322.02115 |
Chemical Identifiers
| CAS Number | 602262-90-8 |
|---|---|
| SMILES | [C-]#[N+]C1CCCC2=CC=CC=C12 |
Product Overview
1,2,3,4-Tetrahydro-1-isocyanonaphthalene (CAS 602262-90-8), with molecular formula C11H11N and molecular weight 157.09 g/mol. IUPAC: 1-isocyano-1,2,3,4-tetrahydronaphthalene.
Chemical Property Profile of 1,2,3,4-Tetrahydro-1-isocyanonaphthalene
Property Insights of 1,2,3,4-Tetrahydro-1-isocyanonaphthalene
The XLogP value of 2.98329 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4-Tetrahydro-1-isocyanonaphthalene. With a topological polar surface area (TPSA) of 4.36 Ų, 1,2,3,4-Tetrahydro-1-isocyanonaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydro-1-isocyanonaphthalene has 0 hydrogen bond donor(s) and 0 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 1,2,3,4-Tetrahydro-1-isocyanonaphthalene?
The CAS number of 1,2,3,4-Tetrahydro-1-isocyanonaphthalene is 602262-90-8.
What is the molecular formula of 1,2,3,4-Tetrahydro-1-isocyanonaphthalene?
The molecular formula of 1,2,3,4-Tetrahydro-1-isocyanonaphthalene is C11H11N.
What is the molecular weight of 1,2,3,4-Tetrahydro-1-isocyanonaphthalene?
The molecular weight of 1,2,3,4-Tetrahydro-1-isocyanonaphthalene is 157.09 g/mol.
Where can I buy 1,2,3,4-Tetrahydro-1-isocyanonaphthalene?
You can request a quote for 1,2,3,4-Tetrahydro-1-isocyanonaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Tetrahydro-1-isocyanonaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydro-1-isocyanonaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.