(3S,6E)-Nerolidol
TL;DR: (3S,6E)-Nerolidol (CAS 142-50-7) 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.
(3S,6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol
Also Known As: NEROLIDOL, (3S,6E)-Nerolidol, Peruviol, Stirrup, trans-Nerolidol
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.3963 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 265.15955 |
Chemical Identifiers
| CAS Number | 142-50-7 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC[C@@](C)(C=C)O)/C)C |
Product Overview
(3S,6E)-Nerolidol (CAS 142-50-7), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: (3S,6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol.
Chemical Property Profile of (3S,6E)-Nerolidol
Property Insights of (3S,6E)-Nerolidol
The XLogP value of 4.3963 indicates that (3S,6E)-Nerolidol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, (3S,6E)-Nerolidol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S,6E)-Nerolidol 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 (3S,6E)-Nerolidol?
The CAS number of (3S,6E)-Nerolidol is 142-50-7.
What is the molecular formula of (3S,6E)-Nerolidol?
The molecular formula of (3S,6E)-Nerolidol is C15H26O.
What is the molecular weight of (3S,6E)-Nerolidol?
The molecular weight of (3S,6E)-Nerolidol is 222.20 g/mol.
Where can I buy (3S,6E)-Nerolidol?
You can request a quote for (3S,6E)-Nerolidol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S,6E)-Nerolidol?
Yes, KEHONG BIO provides custom synthesis services for (3S,6E)-Nerolidol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.