1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
TL;DR: 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one (CAS 75971-86-7) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
Also Known As: PRO063, 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one, 1-(7-Nitro-3,4-dihydroquinolin-1(2H)-yl)propan-1-one, 1-Propanone, 1-(3,4-dihydro-7-nitro-1(2H)-quinolinyl)-
| Molecular Formula | C12H14N2O3 |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 2.284 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.10045 |
| Heavy Atoms | 17 |
| Complexity | 470.81857 |
Chemical Identifiers
| CAS Number | 75971-86-7 |
|---|---|
| SMILES | CCC(=O)N1CCCC2=C1C=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one (CAS 75971-86-7), with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol. IUPAC: 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one.
Chemical Property Profile of 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
Property Insights of 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
The XLogP value of 2.284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one. Following Lipinski's Rule of Five, 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one has 0 hydrogen bond donor(s) and 3 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-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one?
The CAS number of 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one is 75971-86-7.
What is the molecular formula of 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one?
The molecular formula of 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one is C12H14N2O3.
What is the molecular weight of 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one?
The molecular weight of 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one is 234.10 g/mol.
Where can I buy 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one?
You can request a quote for 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(7-nitro-3,4-dihydro-2H-quinolin-1-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.