Beta-citronellol, (S)-
TL;DR: Beta-citronellol, (S)- (CAS 7540-51-4) is a chemical compound with molecular formula C10H20O and molecular weight 156.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3,7-dimethyloct-6-en-1-ol
Also Known As: l-Citronellol, (-)-Citronellol, (S)-(-)-citronellol, (-)-beta-Citronellol, beta-Rhodinol
| Molecular Formula | C10H20O |
|---|---|
| Molecular Weight | 156.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 156.15141 |
| Heavy Atoms | 11 |
| Complexity | 112.0 |
| Boiling Point | 225.00 °C. @ 760.00 mm Hg |
Chemical Identifiers
| CAS Number | 7540-51-4 |
|---|---|
| SMILES | C[C@@H](CCC=C(C)C)CCO |
| InChIKey | QMVPMAAFGQKVCJ-JTQLQIEISA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Beta-citronellol, (S)- (CAS 7540-51-4), with molecular formula C10H20O and molecular weight 156.15 g/mol. IUPAC: (3S)-3,7-dimethyloct-6-en-1-ol.
Chemical Property Profile of Beta-citronellol, (S)-
Property Insights of Beta-citronellol, (S)-
The XLogP value of 3.2 indicates that Beta-citronellol, (S)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Beta-citronellol, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Beta-citronellol, (S)- 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 Beta-citronellol, (S)-?
The CAS number of Beta-citronellol, (S)- is 7540-51-4.
What is the molecular formula of Beta-citronellol, (S)-?
The molecular formula of Beta-citronellol, (S)- is C10H20O.
What is the molecular weight of Beta-citronellol, (S)-?
The molecular weight of Beta-citronellol, (S)- is 156.15 g/mol.
Where can I buy Beta-citronellol, (S)-?
You can request a quote for Beta-citronellol, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Beta-citronellol, (S)-?
Yes, KEHONG BIO provides custom synthesis services for Beta-citronellol, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.