Precyclemone B
TL;DR: Precyclemone B (CAS 52474-60-9) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde
Also Known As: Precyclemone B, Myrmac aldehyde, PrecyclemoneB, 1-methyl-3-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde, 3-Cyclohexene-1-carboxaldehyde, 1-methyl-3-(4-methyl-3-penten-1-yl)-
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 52474-60-9 |
|---|---|
| SMILES | CC(=CCCC1=CCCC(C1)(C)C=O)C |
| InChIKey | MBVBLQFHVRGNLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Precyclemone B (CAS 52474-60-9), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: 1-methyl-3-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde.
Chemical Property Profile of Precyclemone B
Property Insights of Precyclemone B
The XLogP value of 3.3 indicates that Precyclemone B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Precyclemone B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Precyclemone B 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 Precyclemone B?
The CAS number of Precyclemone B is 52474-60-9.
What is the molecular formula of Precyclemone B?
The molecular formula of Precyclemone B is C14H22O.
What is the molecular weight of Precyclemone B?
The molecular weight of Precyclemone B is 206.17 g/mol.
Where can I buy Precyclemone B?
You can request a quote for Precyclemone B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Precyclemone B?
Yes, KEHONG BIO provides custom synthesis services for Precyclemone B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.