![[(E)-3-oxobutan-2-ylideneamino] acetate structure](/static/products/710/71087-81-5.png)
[(E)-3-oxobutan-2-ylideneamino] acetate
TL;DR: [(E)-3-oxobutan-2-ylideneamino] acetate (CAS 71087-81-5) is a chemical compound with molecular formula C6H9NO3 and molecular weight 143.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-3-oxobutan-2-ylideneamino] acetate
Also Known As: biacetyl enol, 3-[(acetyloxy)imino]butan-2-one, [(E)-3-oxobutan-2-ylideneamino] acetate, 2,3-butanedione mono-(O-acetyl oxime), Butane-2,3-dione 2-(O-acetyl oxime)
| Molecular Formula | C6H9NO3 |
|---|---|
| Molecular Weight | 143.06 g/mol |
| LogP | 0.5144 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 143.05824 |
| Heavy Atoms | 10 |
| Complexity | 183.43195 |
Chemical Identifiers
| CAS Number | 71087-81-5 |
|---|---|
| SMILES | C/C(=N\OC(=O)C)/C(=O)C |
Product Overview
[(E)-3-oxobutan-2-ylideneamino] acetate (CAS 71087-81-5), with molecular formula C6H9NO3 and molecular weight 143.06 g/mol. IUPAC: [(E)-3-oxobutan-2-ylideneamino] acetate.
Chemical Property Profile of [(E)-3-oxobutan-2-ylideneamino] acetate
Property Insights of [(E)-3-oxobutan-2-ylideneamino] acetate
The XLogP value of 0.5144 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-3-oxobutan-2-ylideneamino] acetate. With a topological polar surface area (TPSA) of 55.73 Ų, [(E)-3-oxobutan-2-ylideneamino] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(E)-3-oxobutan-2-ylideneamino] acetate has 0 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 [(E)-3-oxobutan-2-ylideneamino] acetate?
The CAS number of [(E)-3-oxobutan-2-ylideneamino] acetate is 71087-81-5.
What is the molecular formula of [(E)-3-oxobutan-2-ylideneamino] acetate?
The molecular formula of [(E)-3-oxobutan-2-ylideneamino] acetate is C6H9NO3.
What is the molecular weight of [(E)-3-oxobutan-2-ylideneamino] acetate?
The molecular weight of [(E)-3-oxobutan-2-ylideneamino] acetate is 143.06 g/mol.
Where can I buy [(E)-3-oxobutan-2-ylideneamino] acetate?
You can request a quote for [(E)-3-oxobutan-2-ylideneamino] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-3-oxobutan-2-ylideneamino] acetate?
Yes, KEHONG BIO provides custom synthesis services for [(E)-3-oxobutan-2-ylideneamino] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.