Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-
TL;DR: Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- (CAS 28745-06-4) is a chemical compound with molecular formula C11H18O2 and molecular weight 182.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-oxo-3-propan-2-ylcyclohexane-1-carbaldehyde
Also Known As: Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-, 3-Isopropyl-6-methyl-2-oxocyclohexanecarbaldehyde, 6-Methyl-3-isopropyl-2-oxocyclohexanecarbaldehyde, 3-Isopropyl-6-methyl-2-oxocyclohexanecarbaldehyde #, 6-methyl-2-oxo-3-(propan-2-yl)cyclohexane-1-carbaldehyde
| Molecular Formula | C11H18O2 |
|---|---|
| Molecular Weight | 182.13 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.13068 |
| Heavy Atoms | 13 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 28745-06-4 |
|---|---|
| SMILES | CC1CCC(C(=O)C1C=O)C(C)C |
| InChIKey | MXTXPQAWZQKTNW-UHFFFAOYSA-N |
Product Overview
Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- (CAS 28745-06-4), with molecular formula C11H18O2 and molecular weight 182.13 g/mol. IUPAC: 6-methyl-2-oxo-3-propan-2-ylcyclohexane-1-carbaldehyde.
Chemical Property Profile of Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-
Property Insights of Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-. With a topological polar surface area (TPSA) of 34.1 Ų, Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- has 0 hydrogen bond donor(s) and 2 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 Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-?
The CAS number of Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- is 28745-06-4.
What is the molecular formula of Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-?
The molecular formula of Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- is C11H18O2.
What is the molecular weight of Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-?
The molecular weight of Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- is 182.13 g/mol.
Where can I buy Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-?
You can request a quote for Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanecarboxaldehyde, 6-methyl-3-(1-methylethyl)-2-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.