(4-Methylcyclohexyl) 2-chloropropanoate
TL;DR: (4-Methylcyclohexyl) 2-chloropropanoate (CAS 90977-00-7) is a chemical compound with molecular formula C10H17ClO2 and molecular weight 204.0917 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methylcyclohexyl) 2-chloropropanoate
Also Known As: (4-methylcyclohexyl) 2-chloropropanoate, 4-Methylcyclohexyl 2-chloropropanoate
Technical Specifications
| Molecular Formula | C10H17ClO2 |
| Molecular Weight | 204.0917 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.0917 Da |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
| SMILES | CC1CCC(CC1)OC(=O)C(C)Cl |
| InChIKey | DRTNJDOUOGLMMX-UHFFFAOYSA-N |
Chemical Property Profile of (4-Methylcyclohexyl) 2-chloropropanoate
Property Insights of (4-Methylcyclohexyl) 2-chloropropanoate
The XLogP value of 3.2 indicates that (4-Methylcyclohexyl) 2-chloropropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (4-Methylcyclohexyl) 2-chloropropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methylcyclohexyl) 2-chloropropanoate 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
What is the CAS number of (4-Methylcyclohexyl) 2-chloropropanoate?
The CAS number of (4-Methylcyclohexyl) 2-chloropropanoate is 90977-00-7.
What is the molecular formula of (4-Methylcyclohexyl) 2-chloropropanoate?
The molecular formula of (4-Methylcyclohexyl) 2-chloropropanoate is C10H17ClO2.
What is the molecular weight of (4-Methylcyclohexyl) 2-chloropropanoate?
The molecular weight of (4-Methylcyclohexyl) 2-chloropropanoate is 204.0917 g/mol.
Where can I buy (4-Methylcyclohexyl) 2-chloropropanoate?
You can request a quote for (4-Methylcyclohexyl) 2-chloropropanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4-Methylcyclohexyl) 2-chloropropanoate?
Yes, CoreyChem provides custom synthesis services for (4-Methylcyclohexyl) 2-chloropropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.