橙花叔醇
TL;DR: 橙花叔醇 (CAS 7212-44-4) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
橙花叔醇
3,7,11-trimethyldodeca-1,6,10-trien-3-ol
Also Known As: NEROLIDOL, Peruviol, Stirrup, trans-Nerolidol, cis-Nerolidol
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
| Melting Point | < 25 °C |
| Boiling Point | 114.00 °C. @ 1.00 mm Hg |
Chemical Identifiers
| CAS Number | 7212-44-4 |
|---|---|
| SMILES | CC(=CCCC(=CCCC(C)(C=C)O)C)C |
| InChIKey | FQTLCLSUCSAZDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
橙花叔醇 (CAS 7212-44-4), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: 3,7,11-trimethyldodeca-1,6,10-trien-3-ol.
Chemical Property Profile of 橙花叔醇
Property Insights of 橙花叔醇
The XLogP value of 4.6 indicates that 橙花叔醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 橙花叔醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 橙花叔醇 has 1 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 橙花叔醇?
The CAS number of 橙花叔醇 is 7212-44-4.
What is the molecular formula of 橙花叔醇?
The molecular formula of 橙花叔醇 is C15H26O.
What is the molecular weight of 橙花叔醇?
The molecular weight of 橙花叔醇 is 222.20 g/mol.
Where can I buy 橙花叔醇?
You can request a quote for 橙花叔醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 橙花叔醇?
Yes, KEHONG BIO provides custom synthesis services for 橙花叔醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.