1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one
TL;DR: 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one (CAS 81075-14-1) is a chemical compound with molecular formula C12H13ClN2O2 and molecular weight 252.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one
Also Known As: 2,3-Dihydro-6-chloro-1-(1-oxopropyl)-4(1H)-quinolinone 4-oxime, 2,3-DIHYDRO-6-CHLORO-1-(1-OXOPROPYL)-4-1H-QUINOLINONE 4-OXIME
| Molecular Formula | C12H13ClN2O2 |
|---|---|
| Molecular Weight | 252.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 252.06656 |
| Heavy Atoms | 17 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 81075-14-1 |
|---|---|
| SMILES | CCC(=O)N1CCC(=NO)C2=C1C=CC(=C2)Cl |
| InChIKey | ABELRHWKDXLRAR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one (CAS 81075-14-1), with molecular formula C12H13ClN2O2 and molecular weight 252.07 g/mol. IUPAC: 1-(6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one.
Chemical Property Profile of 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one
Property Insights of 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one. With a topological polar surface area (TPSA) of 52.9 Ų, 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one has 1 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-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one?
The CAS number of 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one is 81075-14-1.
What is the molecular formula of 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one?
The molecular formula of 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one is C12H13ClN2O2.
What is the molecular weight of 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one?
The molecular weight of 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one is 252.07 g/mol.
Where can I buy 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one?
You can request a quote for 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-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-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-Chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.