3-Amino-3-methylbutan-2-one oxime
TL;DR: 3-Amino-3-methylbutan-2-one oxime (CAS 79137-32-9) is a chemical compound with molecular formula C5H12N2O and molecular weight 116.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-(3-amino-3-methylbutan-2-ylidene)hydroxylamine
Also Known As: 2-amino-2-methyl-3-butanone oxime, 3-amino-3-methylbutan-2-one oxime, 2-Butanone, 3-amino-3-methyl-, oxime, 3-amino-3-methyl-butan-2-one (E)-oxime, (NE)-N-(3-amino-3-methylbutan-2-ylidene)hydroxylamine
| Molecular Formula | C5H12N2O |
|---|---|
| Molecular Weight | 116.09 g/mol |
| LogP | 0.5738 |
| Topological Polar Surface Area | 58.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 116.09496 |
| Heavy Atoms | 8 |
| Complexity | 101.48652 |
Chemical Identifiers
| CAS Number | 79137-32-9 |
|---|---|
| SMILES | C/C(=N\O)/C(C)(C)N |
Product Overview
3-Amino-3-methylbutan-2-one oxime (CAS 79137-32-9), with molecular formula C5H12N2O and molecular weight 116.09 g/mol. IUPAC: (NE)-N-(3-amino-3-methylbutan-2-ylidene)hydroxylamine.
Chemical Property Profile of 3-Amino-3-methylbutan-2-one oxime
Property Insights of 3-Amino-3-methylbutan-2-one oxime
The XLogP value of 0.5738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-3-methylbutan-2-one oxime. With a topological polar surface area (TPSA) of 58.61 Ų, 3-Amino-3-methylbutan-2-one oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-3-methylbutan-2-one oxime has 2 hydrogen bond donor(s) and 3 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-3-methylbutan-2-one oxime?
The CAS number of 3-Amino-3-methylbutan-2-one oxime is 79137-32-9.
What is the molecular formula of 3-Amino-3-methylbutan-2-one oxime?
The molecular formula of 3-Amino-3-methylbutan-2-one oxime is C5H12N2O.
What is the molecular weight of 3-Amino-3-methylbutan-2-one oxime?
The molecular weight of 3-Amino-3-methylbutan-2-one oxime is 116.09 g/mol.
Where can I buy 3-Amino-3-methylbutan-2-one oxime?
You can request a quote for 3-Amino-3-methylbutan-2-one oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-3-methylbutan-2-one oxime?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-3-methylbutan-2-one oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.