Geijerone
TL;DR: Geijerone (CAS 5400-86-2) is a chemical compound with molecular formula C12H18O and molecular weight 178.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(3S,4R)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexan-1-one
Also Known As: Geijerone, Gejeron, KST-1A5581, 3-Isopropenyl-4-methyl-4-vinylcyclohexanone, (3s,4r)-4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexanone
| Molecular Formula | C12H18O |
|---|---|
| Molecular Weight | 178.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.13577 |
| Heavy Atoms | 13 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 5400-86-2 |
|---|---|
| SMILES | CC(=C)[C@@H]1CC(=O)CC[C@]1(C)C=C |
| InChIKey | TYUCDLXRFGFSBR-RYUDHWBXSA-N |
Product Overview
Geijerone (CAS 5400-86-2), with molecular formula C12H18O and molecular weight 178.14 g/mol. IUPAC: trans-(3S,4R)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexan-1-one.
Chemical Property Profile of Geijerone
Property Insights of Geijerone
The XLogP value of 3.0 indicates that Geijerone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Geijerone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Geijerone has 0 hydrogen bond donor(s) and 1 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 Geijerone?
The CAS number of Geijerone is 5400-86-2.
What is the molecular formula of Geijerone?
The molecular formula of Geijerone is C12H18O.
What is the molecular weight of Geijerone?
The molecular weight of Geijerone is 178.14 g/mol.
Where can I buy Geijerone?
You can request a quote for Geijerone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Geijerone?
Yes, KEHONG BIO provides custom synthesis services for Geijerone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.