3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one
TL;DR: 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one (CAS 13594-38-2) is a chemical compound with molecular formula C6H11NO3 and molecular weight 145.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one
Also Known As: 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one, 2(3H)-Furanone, 3-aminodihydro-5-(hydroxymethyl)-4-methyl-, 3-Aminotetrahydro-5-(hydroxymethyl)-4-methylfuran-2-one, RefChem:313852
| Molecular Formula | C6H11NO3 |
|---|---|
| Molecular Weight | 145.07 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.0739 |
| Heavy Atoms | 10 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 13594-38-2 |
|---|---|
| SMILES | CC1C(OC(=O)C1N)CO |
| InChIKey | QEXHWBBFAYIAIZ-UHFFFAOYSA-N |
Product Overview
3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one (CAS 13594-38-2), with molecular formula C6H11NO3 and molecular weight 145.07 g/mol. IUPAC: 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one.
Chemical Property Profile of 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one
Property Insights of 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one
The XLogP value of -0.8 indicates that 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one. Following Lipinski's Rule of Five, 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one has 2 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 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one?
The CAS number of 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one is 13594-38-2.
What is the molecular formula of 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one?
The molecular formula of 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one is C6H11NO3.
What is the molecular weight of 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one?
The molecular weight of 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one is 145.07 g/mol.
Where can I buy 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one?
You can request a quote for 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-5-(hydroxymethyl)-4-methyloxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.