羟基香茅醛
TL;DR: 羟基香茅醛 (CAS 107-75-5) is a chemical compound with molecular formula C10H20O2 and molecular weight 172.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟基香茅醛
7-hydroxy-3,7-dimethyloctanal
Also Known As: Hydroxycitronellal, 7-Hydroxy-3,7-dimethyloctanal, 7-Hydroxycitronellal, Citronellal hydrate, Phixia
| Molecular Formula | C10H20O2 |
|---|---|
| Molecular Weight | 172.15 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 172.14633 |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
| Boiling Point | 241.00 °C. @ 760.00 mm Hg |
| Density | 0.918-0.923 |
| Solubility | slightly |
| Refractive Index | 1.447-1.450 |
Chemical Identifiers
| CAS Number | 107-75-5 |
|---|---|
| SMILES | CC(CCCC(C)(C)O)CC=O |
| InChIKey | WPFVBOQKRVRMJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟基香茅醛 (CAS 107-75-5), with molecular formula C10H20O2 and molecular weight 172.15 g/mol. IUPAC: 7-hydroxy-3,7-dimethyloctanal.
Chemical Property Profile of 羟基香茅醛
Property Insights of 羟基香茅醛
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 羟基香茅醛. With a topological polar surface area (TPSA) of 37.3 Ų, 羟基香茅醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 羟基香茅醛 has 1 hydrogen bond donor(s) and 2 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 羟基香茅醛?
The CAS number of 羟基香茅醛 is 107-75-5.
What is the molecular formula of 羟基香茅醛?
The molecular formula of 羟基香茅醛 is C10H20O2.
What is the molecular weight of 羟基香茅醛?
The molecular weight of 羟基香茅醛 is 172.15 g/mol.
Where can I buy 羟基香茅醛?
You can request a quote for 羟基香茅醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟基香茅醛?
Yes, KEHONG BIO provides custom synthesis services for 羟基香茅醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.