3,3,5-Trimethylcyclohexane-1-carbaldehyde
TL;DR: 3,3,5-Trimethylcyclohexane-1-carbaldehyde (CAS 1845-38-1) is a chemical compound with molecular formula C10H18O and molecular weight 154.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,5-trimethylcyclohexane-1-carbaldehyde
Also Known As: 3,3,5-trimethylcyclohexanecarbaldehyde, 3,3,5-Trimethylcyclohexanecarboxaldehyde, 3,3,5-trimethylcyclohexane-1-carbaldehyde, 3,5,5-Trimethylcyklohexankarbaldehyd, 3,5,5-Trimethylcyklohexankarbaldehyd [Czech]
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 1845-38-1 |
|---|---|
| SMILES | CC1CC(CC(C1)(C)C)C=O |
| InChIKey | XOKRGEQPFOCUDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3,5-Trimethylcyclohexane-1-carbaldehyde (CAS 1845-38-1), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 3,3,5-trimethylcyclohexane-1-carbaldehyde.
Chemical Property Profile of 3,3,5-Trimethylcyclohexane-1-carbaldehyde
Property Insights of 3,3,5-Trimethylcyclohexane-1-carbaldehyde
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,5-Trimethylcyclohexane-1-carbaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 3,3,5-Trimethylcyclohexane-1-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,5-Trimethylcyclohexane-1-carbaldehyde 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 3,3,5-Trimethylcyclohexane-1-carbaldehyde?
The CAS number of 3,3,5-Trimethylcyclohexane-1-carbaldehyde is 1845-38-1.
What is the molecular formula of 3,3,5-Trimethylcyclohexane-1-carbaldehyde?
The molecular formula of 3,3,5-Trimethylcyclohexane-1-carbaldehyde is C10H18O.
What is the molecular weight of 3,3,5-Trimethylcyclohexane-1-carbaldehyde?
The molecular weight of 3,3,5-Trimethylcyclohexane-1-carbaldehyde is 154.14 g/mol.
Where can I buy 3,3,5-Trimethylcyclohexane-1-carbaldehyde?
You can request a quote for 3,3,5-Trimethylcyclohexane-1-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,5-Trimethylcyclohexane-1-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3,3,5-Trimethylcyclohexane-1-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.