2-(Isopropyl)-5-methylcyclohexanecarbaldehyde
TL;DR: 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde (CAS 1845-44-9) is a chemical compound with molecular formula C11H20O and molecular weight 168.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-propan-2-ylcyclohexane-1-carbaldehyde
Also Known As: p-menthane-3-carboxaldehyde, p-Menthane-3-carbaldehyde, 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde, 2-isopropyl-5-methylcyclohexanecarbaldehyde, 5-methyl-2-propan-2-ylcyclohexane-1-carbaldehyde
| Molecular Formula | C11H20O |
|---|---|
| Molecular Weight | 168.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.15141 |
| Heavy Atoms | 12 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 1845-44-9 |
|---|---|
| SMILES | CC1CCC(C(C1)C=O)C(C)C |
| InChIKey | AUABNXZOGNPUSY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Isopropyl)-5-methylcyclohexanecarbaldehyde (CAS 1845-44-9), with molecular formula C11H20O and molecular weight 168.15 g/mol. IUPAC: 5-methyl-2-propan-2-ylcyclohexane-1-carbaldehyde.
Chemical Property Profile of 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde
Property Insights of 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde
The XLogP value of 3.3 indicates that 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde 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 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde?
The CAS number of 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde is 1845-44-9.
What is the molecular formula of 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde?
The molecular formula of 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde is C11H20O.
What is the molecular weight of 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde?
The molecular weight of 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde is 168.15 g/mol.
Where can I buy 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde?
You can request a quote for 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(Isopropyl)-5-methylcyclohexanecarbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.