1-环己烯基磷酸二乙酯
TL;DR: 1-环己烯基磷酸二乙酯 (CAS 4452-32-8) is a chemical compound with molecular formula C10H19O4P and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-环己烯基磷酸二乙酯
cyclohexen-1-yl diethyl phosphate
Also Known As: Shell SD-2218, Shell SD 2218, cyclohexen-1-yl diethyl phosphate, 1-Cyclohexen-1-yl diethyl phosphate, 1-Cyclohexen-1-yl ethyl phosphate
| Molecular Formula | C10H19O4P |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 234.1021 |
| Heavy Atoms | 15 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 4452-32-8 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC1=CCCCC1 |
| InChIKey | HSZLFXQMARYHGS-UHFFFAOYSA-N |
Product Overview
1-环己烯基磷酸二乙酯 (CAS 4452-32-8), with molecular formula C10H19O4P and molecular weight 234.10 g/mol. IUPAC: cyclohexen-1-yl diethyl phosphate.
Chemical Property Profile of 1-环己烯基磷酸二乙酯
Property Insights of 1-环己烯基磷酸二乙酯
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-环己烯基磷酸二乙酯. With a topological polar surface area (TPSA) of 44.8 Ų, 1-环己烯基磷酸二乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-环己烯基磷酸二乙酯 has 0 hydrogen bond donor(s) and 4 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 1-环己烯基磷酸二乙酯?
The CAS number of 1-环己烯基磷酸二乙酯 is 4452-32-8.
What is the molecular formula of 1-环己烯基磷酸二乙酯?
The molecular formula of 1-环己烯基磷酸二乙酯 is C10H19O4P.
What is the molecular weight of 1-环己烯基磷酸二乙酯?
The molecular weight of 1-环己烯基磷酸二乙酯 is 234.10 g/mol.
Where can I buy 1-环己烯基磷酸二乙酯?
You can request a quote for 1-环己烯基磷酸二乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-环己烯基磷酸二乙酯?
Yes, KEHONG BIO provides custom synthesis services for 1-环己烯基磷酸二乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.