环己基间甲苯基酮
TL;DR: 环己基间甲苯基酮 (CAS 3277-78-9) is a chemical compound with molecular formula C14H18O and molecular weight 202.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环己基间甲苯基酮
cyclohexyl-(3-methylphenyl)methanone
Also Known As: Cyclohexyl m-tolyl ketone, CYCLOHEXYL 3-METHYLPHENYL KETONE, cyclohexyl(m-tolyl)methanone, cyclohexyl-(3-methylphenyl)methanone, cyclohexyl(3-methylphenyl)methanone
| Molecular Formula | C14H18O |
|---|---|
| Molecular Weight | 202.14 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.13577 |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 3277-78-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)C2CCCCC2 |
| InChIKey | QGCLTCPKWGVNFG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
环己基间甲苯基酮 (CAS 3277-78-9), with molecular formula C14H18O and molecular weight 202.14 g/mol. IUPAC: cyclohexyl-(3-methylphenyl)methanone.
Chemical Property Profile of 环己基间甲苯基酮
Property Insights of 环己基间甲苯基酮
The XLogP value of 4.1 indicates that 环己基间甲苯基酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 环己基间甲苯基酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环己基间甲苯基酮 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 环己基间甲苯基酮?
The CAS number of 环己基间甲苯基酮 is 3277-78-9.
What is the molecular formula of 环己基间甲苯基酮?
The molecular formula of 环己基间甲苯基酮 is C14H18O.
What is the molecular weight of 环己基间甲苯基酮?
The molecular weight of 环己基间甲苯基酮 is 202.14 g/mol.
Where can I buy 环己基间甲苯基酮?
You can request a quote for 环己基间甲苯基酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环己基间甲苯基酮?
Yes, KEHONG BIO provides custom synthesis services for 环己基间甲苯基酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.