trans-Carvyl propionate
TL;DR: trans-Carvyl propionate (CAS 145032-51-5) is a chemical compound with molecular formula C13H20O2 and molecular weight 208.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl] propanoate
Also Known As: Carvyl propionate, trans-Carvyl propionate, 5-Isopropenyl-2-methyl-2-cyclohexen-1-yl propionate #, [(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl] propanoate
Technical Specifications
| Molecular Formula | C13H20O2 |
| Molecular Weight | 208.14633 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.14633 Da |
| Heavy Atoms | 15 |
| Complexity | 289.0 |
| SMILES | CCC(=O)O[C@@H]1C[C@H](CC=C1C)C(=C)C |
| InChIKey | DFVXNZOMAOGTBL-NWDGAFQWSA-N |
Chemical Property Profile of trans-Carvyl propionate
Property Insights of trans-Carvyl propionate
The XLogP value of 3.1 indicates that trans-Carvyl propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, trans-Carvyl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-Carvyl propionate 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 trans-Carvyl propionate?
The CAS number of trans-Carvyl propionate is 145032-51-5.
What is the molecular formula of trans-Carvyl propionate?
The molecular formula of trans-Carvyl propionate is C13H20O2.
What is the molecular weight of trans-Carvyl propionate?
The molecular weight of trans-Carvyl propionate is 208.14633 g/mol.
Where can I buy trans-Carvyl propionate?
You can request a quote for trans-Carvyl propionate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for trans-Carvyl propionate?
Yes, CoreyChem provides custom synthesis services for trans-Carvyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.