Pinocarvyl acetate, trans-(+)-
TL;DR: Pinocarvyl acetate, trans-(+)- (CAS 1686-15-3) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,3S,5R)-6,6-dimethyl-2-methylidene-3-bicyclo[3.1.1]heptanyl] acetate
Also Known As: Pinocarvyl acetate, Pinocarvyl acetate, trans-, cis-Pinocarveol, acetate, Fema No. 4807, trans-, Pinocarvyl acetate, trans-(+)-
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 2.5403 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 290.69687 |
Chemical Identifiers
| CAS Number | 1686-15-3 |
|---|---|
| SMILES | CC(=O)O[C@H]1C[C@H]2C[C@@H](C1=C)C2(C)C |
Product Overview
Pinocarvyl acetate, trans-(+)- (CAS 1686-15-3), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: [(1R,3S,5R)-6,6-dimethyl-2-methylidene-3-bicyclo[3.1.1]heptanyl] acetate.
Chemical Property Profile of Pinocarvyl acetate, trans-(+)-
Property Insights of Pinocarvyl acetate, trans-(+)-
The XLogP value of 2.5403 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pinocarvyl acetate, trans-(+)-. With a topological polar surface area (TPSA) of 26.3 Ų, Pinocarvyl acetate, trans-(+)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pinocarvyl acetate, trans-(+)- 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 Pinocarvyl acetate, trans-(+)-?
The CAS number of Pinocarvyl acetate, trans-(+)- is 1686-15-3.
What is the molecular formula of Pinocarvyl acetate, trans-(+)-?
The molecular formula of Pinocarvyl acetate, trans-(+)- is C12H18O2.
What is the molecular weight of Pinocarvyl acetate, trans-(+)-?
The molecular weight of Pinocarvyl acetate, trans-(+)- is 194.13 g/mol.
Where can I buy Pinocarvyl acetate, trans-(+)-?
You can request a quote for Pinocarvyl acetate, trans-(+)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pinocarvyl acetate, trans-(+)-?
Yes, KEHONG BIO provides custom synthesis services for Pinocarvyl acetate, trans-(+)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.