Abietate
TL;DR: Abietate (CAS 10248-55-2) is a chemical compound with molecular formula C20H29O2- and molecular weight 301.21677 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate
Also Known As: Abietate, Sylvic acid, COPPER ABIETATE, abieta-7,13-diene-18-oate, ABIETIC ACID
Technical Specifications
| Molecular Formula | C20H29O2- |
| Molecular Weight | 301.21677 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 40.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.21677 Da |
| Heavy Atoms | 22 |
| Complexity | 536.0 |
| SMILES | CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)[O-])C |
| InChIKey | RSWGJHLUYNHPMX-ONCXSQPRSA-M |
Chemical Property Profile of Abietate
Property Insights of Abietate
The XLogP value of 5.4 indicates that Abietate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.1 Ų, Abietate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Abietate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Abietate?
The CAS number of Abietate is 10248-55-2.
What is the molecular formula of Abietate?
The molecular formula of Abietate is C20H29O2-.
What is the molecular weight of Abietate?
The molecular weight of Abietate is 301.21677 g/mol.
Where can I buy Abietate?
You can request a quote for Abietate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Abietate?
Yes, CoreyChem provides custom synthesis services for Abietate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.