1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-
TL;DR: 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- (CAS 54335-70-5) is a chemical compound with molecular formula C8H12N2O3S and molecular weight 216.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-(5-methyl-1,3-oxathiolan-4-ylidene)amino] N-prop-2-enylcarbamate
Also Known As: syn-5-Methyl-1,3-oxathiolan-4-one O-((acetylmethylamino)carbonyl)oxime, 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-, RefChem:219373
| Molecular Formula | C8H12N2O3S |
|---|---|
| Molecular Weight | 216.06 g/mol |
| LogP | 1.3215 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.05687 |
| Heavy Atoms | 14 |
| Complexity | 254.97095 |
Chemical Identifiers
| CAS Number | 54335-70-5 |
|---|---|
| SMILES | CC1/C(=N/OC(=O)NCC=C)/SCO1 |
Product Overview
1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- (CAS 54335-70-5), with molecular formula C8H12N2O3S and molecular weight 216.06 g/mol. IUPAC: [(Z)-(5-methyl-1,3-oxathiolan-4-ylidene)amino] N-prop-2-enylcarbamate.
Chemical Property Profile of 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-
Property Insights of 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-
The XLogP value of 1.3215 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-. With a topological polar surface area (TPSA) of 59.92 Ų, 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- 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 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-?
The CAS number of 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- is 54335-70-5.
What is the molecular formula of 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-?
The molecular formula of 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- is C8H12N2O3S.
What is the molecular weight of 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-?
The molecular weight of 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- is 216.06 g/mol.
Where can I buy 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-?
You can request a quote for 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Oxathiolan-4-one, 5-methyl-, O-((acetylmethylamino)carbonyl)oxime, syn- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.