(+)-Neomenthyl acetate
TL;DR: (+)-Neomenthyl acetate (CAS 2552-91-2) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] acetate
Also Known As: Neomenthyl acetate, (1S)-(+)-Neomenthyl acetate, Bromocolchicine, mentyl acetate, (+)-Neomenthyl acetate
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 2552-91-2 |
|---|---|
| SMILES | C[C@@H]1CC[C@H]([C@H](C1)OC(=O)C)C(C)C |
| InChIKey | XHXUANMFYXWVNG-USWWRNFRSA-N |
Product Overview
(+)-Neomenthyl acetate (CAS 2552-91-2), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] acetate.
Chemical Property Profile of (+)-Neomenthyl acetate
Property Insights of (+)-Neomenthyl acetate
The XLogP value of 3.6 indicates that (+)-Neomenthyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (+)-Neomenthyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-Neomenthyl 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 (+)-Neomenthyl acetate?
The CAS number of (+)-Neomenthyl acetate is 2552-91-2.
What is the molecular formula of (+)-Neomenthyl acetate?
The molecular formula of (+)-Neomenthyl acetate is C12H22O2.
What is the molecular weight of (+)-Neomenthyl acetate?
The molecular weight of (+)-Neomenthyl acetate is 198.16 g/mol.
Where can I buy (+)-Neomenthyl acetate?
You can request a quote for (+)-Neomenthyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Neomenthyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (+)-Neomenthyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.