3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-
TL;DR: 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- (CAS 77921-26-7) is a chemical compound with molecular formula C17H25ClOS and molecular weight 312.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenyl)-1-ethylsulfanylnonan-3-one
Also Known As: 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-, 1-(2-chlorophenyl)-1-ethylsulfanylnonan-3-one, 1-(2-Chlorophenyl)-1-(ethylsulfanyl)nonan-3-one
| Molecular Formula | C17H25ClOS |
|---|---|
| Molecular Weight | 312.13 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 312.13147 |
| Heavy Atoms | 20 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 77921-26-7 |
|---|---|
| SMILES | CCCCCCC(=O)CC(C1=CC=CC=C1Cl)SCC |
| InChIKey | JSVAEMAUWAYRBY-UHFFFAOYSA-N |
Product Overview
3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- (CAS 77921-26-7), with molecular formula C17H25ClOS and molecular weight 312.13 g/mol. IUPAC: 1-(2-chlorophenyl)-1-ethylsulfanylnonan-3-one.
Chemical Property Profile of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-
Property Insights of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-
The XLogP value of 5.5 indicates that 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-?
The CAS number of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- is 77921-26-7.
What is the molecular formula of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-?
The molecular formula of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- is C17H25ClOS.
What is the molecular weight of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-?
The molecular weight of 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- is 312.13 g/mol.
Where can I buy 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-?
You can request a quote for 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Nonanone, 1-(2-chlorophenyl)-1-(ethylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.