Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-
TL;DR: Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- (CAS 832113-76-5) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-isocyanoethyl)-3,4-dihydro-2H-quinoline
Also Known As: 1-(2-isocyanoethyl)-3,4-dihydro-2H-quinoline, 1-(2-Isocyanoethyl)-1,2,3,4-tetrahydroquinoline, 1-(2-isocyano-ethyl)-1,2,3,4-tetrahydro-naphthalene, Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-
| Molecular Formula | C12H14N2 |
|---|---|
| Molecular Weight | 186.12 g/mol |
| LogP | 2.35849 |
| Topological Polar Surface Area | 7.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.11569 |
| Heavy Atoms | 14 |
| Complexity | 351.5845 |
Chemical Identifiers
| CAS Number | 832113-76-5 |
|---|---|
| SMILES | [C-]#[N+]CCN1CCCC2=CC=CC=C21 |
Product Overview
Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- (CAS 832113-76-5), with molecular formula C12H14N2 and molecular weight 186.12 g/mol. IUPAC: 1-(2-isocyanoethyl)-3,4-dihydro-2H-quinoline.
Chemical Property Profile of Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-
Property Insights of Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-
The XLogP value of 2.35849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-. With a topological polar surface area (TPSA) of 7.6 Ų, Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- 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 Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-?
The CAS number of Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- is 832113-76-5.
What is the molecular formula of Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-?
The molecular formula of Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- is C12H14N2.
What is the molecular weight of Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-?
The molecular weight of Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- is 186.12 g/mol.
Where can I buy Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-?
You can request a quote for Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Quinoline, 1,2,3,4-tetrahydro-1-(2-isocyanoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.