Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-
TL;DR: Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- (CAS 64486-02-8) is a chemical compound with molecular formula C9H15NO4 and molecular weight 201.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-oxo-2-propan-2-yloxyiminobutanoate
Also Known As: ethyl 2-iso-propoxyimino-3-oxobutyrate, ethyl 2acetyl-2-(1-methylethoxyimino)-acetate, ethyl 2-acetyl-2-(1-methylethoxyimino)-acetate, Ethyl 3-oxo-2-{[(propan-2-yl)oxy]imino}butanoate, Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-
| Molecular Formula | C9H15NO4 |
|---|---|
| Molecular Weight | 201.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 201.10011 |
| Heavy Atoms | 14 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 64486-02-8 |
|---|---|
| SMILES | CCOC(=O)C(=NOC(C)C)C(=O)C |
| InChIKey | JQZYTHDHNWNPHI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- (CAS 64486-02-8), with molecular formula C9H15NO4 and molecular weight 201.10 g/mol. IUPAC: ethyl 3-oxo-2-propan-2-yloxyiminobutanoate.
Chemical Property Profile of Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-
Property Insights of Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-. Following Lipinski's Rule of Five, Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- has 0 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 Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-?
The CAS number of Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- is 64486-02-8.
What is the molecular formula of Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-?
The molecular formula of Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- is C9H15NO4.
What is the molecular weight of Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-?
The molecular weight of Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- is 201.10 g/mol.
Where can I buy Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-?
You can request a quote for Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 2-[(1-methylethoxy)imino]-3-oxo-, ethyl ester, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.