3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one
TL;DR: 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one (CAS 396105-46-7) is a chemical compound with molecular formula C14H13Cl2NO and molecular weight 281.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,3-dichloroprop-2-enyl)-4,8-dimethyl-1H-quinolin-2-one
Also Known As: 3-(3,3-dichloroallyl)-4,8-dimethylquinolin-2(1H)-one, 3-(3,3-dichloroprop-2-enyl)-4,8-dimethyl-1H-quinolin-2-one, 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one, 3-(3,3-dichloroprop-2-en-1-yl)-4,8-dimethylquinolin-2-ol, 3-(3,3-dichloroprop-2-en-1-yl)-4,8-dimethylquinolin-2(1H)-one
| Molecular Formula | C14H13Cl2NO |
|---|---|
| Molecular Weight | 281.04 g/mol |
| LogP | 4.00644 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.0374 |
| Heavy Atoms | 18 |
| Complexity | 681.98883 |
Chemical Identifiers
| CAS Number | 396105-46-7 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=C(C(=O)N2)CC=C(Cl)Cl)C |
Product Overview
3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one (CAS 396105-46-7), with molecular formula C14H13Cl2NO and molecular weight 281.04 g/mol. IUPAC: 3-(3,3-dichloroprop-2-enyl)-4,8-dimethyl-1H-quinolin-2-one.
Chemical Property Profile of 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one
Property Insights of 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one
The XLogP value of 4.00644 indicates that 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.86 Ų, 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one has 1 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 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one?
The CAS number of 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one is 396105-46-7.
What is the molecular formula of 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one?
The molecular formula of 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one is C14H13Cl2NO.
What is the molecular weight of 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one?
The molecular weight of 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one is 281.04 g/mol.
Where can I buy 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one?
You can request a quote for 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,3-Dichloro-allyl)-4,8-dimethyl-1H-quinolin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.