3-Isoxazolidinone, 2-isopropyl-
TL;DR: 3-Isoxazolidinone, 2-isopropyl- (CAS 40784-18-7) is a chemical compound with molecular formula C6H11NO2 and molecular weight 129.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-yl-1,2-oxazolidin-3-one
Also Known As: 2-Isopropylisoxazolid-3(2H)-one, 3-ISOXAZOLIDINONE, 2-ISOPROPYL-, 2-Isopropylisoxazolidin-3-one, 2-propan-2-yl-1,2-oxazolidin-3-one, 2-ISOPROPYL-3-ISOXAZOLIDINONE
| Molecular Formula | C6H11NO2 |
|---|---|
| Molecular Weight | 129.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 129.07898 |
| Heavy Atoms | 9 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 40784-18-7 |
|---|---|
| SMILES | CC(C)N1C(=O)CCO1 |
| InChIKey | OODXRKGBMISMPF-UHFFFAOYSA-N |
Product Overview
3-Isoxazolidinone, 2-isopropyl- (CAS 40784-18-7), with molecular formula C6H11NO2 and molecular weight 129.08 g/mol. IUPAC: 2-propan-2-yl-1,2-oxazolidin-3-one.
Chemical Property Profile of 3-Isoxazolidinone, 2-isopropyl-
Property Insights of 3-Isoxazolidinone, 2-isopropyl-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Isoxazolidinone, 2-isopropyl-. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Isoxazolidinone, 2-isopropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Isoxazolidinone, 2-isopropyl- has 0 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 3-Isoxazolidinone, 2-isopropyl-?
The CAS number of 3-Isoxazolidinone, 2-isopropyl- is 40784-18-7.
What is the molecular formula of 3-Isoxazolidinone, 2-isopropyl-?
The molecular formula of 3-Isoxazolidinone, 2-isopropyl- is C6H11NO2.
What is the molecular weight of 3-Isoxazolidinone, 2-isopropyl-?
The molecular weight of 3-Isoxazolidinone, 2-isopropyl- is 129.08 g/mol.
Where can I buy 3-Isoxazolidinone, 2-isopropyl-?
You can request a quote for 3-Isoxazolidinone, 2-isopropyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isoxazolidinone, 2-isopropyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Isoxazolidinone, 2-isopropyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.