alpha-Terpinyl acetate, (-)-
TL;DR: alpha-Terpinyl acetate, (-)- (CAS 58206-95-4) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-yl acetate
Also Known As: A-terpineol acetate, 1-alpha-Terpinyl acetate, 1S-Terpinyl Acetate, Cobalt, tetracarbonyl, d-\a-Terpineol acetate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 58206-95-4 |
|---|---|
| SMILES | CC1=CC[C@H](CC1)C(C)(C)OC(=O)C |
| InChIKey | IGODOXYLBBXFDW-LLVKDONJSA-N |
Product Overview
alpha-Terpinyl acetate, (-)- (CAS 58206-95-4), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-yl acetate.
Chemical Property Profile of alpha-Terpinyl acetate, (-)-
Property Insights of alpha-Terpinyl acetate, (-)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Terpinyl acetate, (-)-. With a topological polar surface area (TPSA) of 26.3 Ų, alpha-Terpinyl acetate, (-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Terpinyl acetate, (-)- 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 alpha-Terpinyl acetate, (-)-?
The CAS number of alpha-Terpinyl acetate, (-)- is 58206-95-4.
What is the molecular formula of alpha-Terpinyl acetate, (-)-?
The molecular formula of alpha-Terpinyl acetate, (-)- is C12H20O2.
What is the molecular weight of alpha-Terpinyl acetate, (-)-?
The molecular weight of alpha-Terpinyl acetate, (-)- is 196.15 g/mol.
Where can I buy alpha-Terpinyl acetate, (-)-?
You can request a quote for alpha-Terpinyl acetate, (-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Terpinyl acetate, (-)-?
Yes, KEHONG BIO provides custom synthesis services for alpha-Terpinyl acetate, (-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.