2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one
TL;DR: 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one (CAS 108331-14-2) is a chemical compound with molecular formula C9H17O5P and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-hydroxy-3,5,5-trimethyl-2-oxo-1,2λ5-oxaphosphinan-2-yl) acetate
Also Known As: (3-hydroxy-3,5,5-trimethyl-2-oxo-1,2, cis-2-Methoxy-3,5,5-trimethyl-1,2-oxaphospholan-3-ol acetate 2-oxide, 1,2-OXAPHOSPHOLAN-3-OL, 2-METHOXY-3,5,5-TRIMETHYL-, ACETATE, 2-OXIDE, cis-, 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one, 2-(acetyloxy)-3,5,5-trimethyl-1,2-oxaphosphinan-3-ol 2-oxide
| Molecular Formula | C9H17O5P |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.08136 |
| Heavy Atoms | 15 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 108331-14-2 |
|---|---|
| SMILES | CC(=O)OP1(=O)C(CC(CO1)(C)C)(C)O |
| InChIKey | JNPFXCVABAZXKF-UHFFFAOYSA-N |
Product Overview
2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one (CAS 108331-14-2), with molecular formula C9H17O5P and molecular weight 236.08 g/mol. IUPAC: (3-hydroxy-3,5,5-trimethyl-2-oxo-1,2λ5-oxaphosphinan-2-yl) acetate.
Chemical Property Profile of 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one
Property Insights of 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one. Following Lipinski's Rule of Five, 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one has 1 hydrogen bond donor(s) and 5 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 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one?
The CAS number of 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one is 108331-14-2.
What is the molecular formula of 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one?
The molecular formula of 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one is C9H17O5P.
What is the molecular weight of 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one?
The molecular weight of 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one is 236.08 g/mol.
Where can I buy 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one?
You can request a quote for 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(Acetyloxy)-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphosphinan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.