![N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine structure](/static/products/4780/478043-05-9.webp)
N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine
TL;DR: N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine (CAS 478043-05-9) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine
Also Known As: N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine, 3,3-dimethyl-1-(2-nitrophenoxy)-2-butanone oxime
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 2.8499 |
| Topological Polar Surface Area | 84.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 463.39038 |
Chemical Identifiers
| CAS Number | 478043-05-9 |
|---|---|
| SMILES | CC(C)(C)C(=NO)COC1=CC=CC=C1[N+](=O)[O-] |
Product Overview
N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine (CAS 478043-05-9), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine.
Chemical Property Profile of N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine
Property Insights of N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine
The XLogP value of 2.8499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine. The TPSA of 84.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine. Following Lipinski's Rule of Five, N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine 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 N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine?
The CAS number of N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine is 478043-05-9.
What is the molecular formula of N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine?
The molecular formula of N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine is C12H16N2O4.
What is the molecular weight of N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine?
The molecular weight of N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine is 252.11 g/mol.
Where can I buy N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine?
You can request a quote for N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine?
Yes, KEHONG BIO provides custom synthesis services for N-[3,3-dimethyl-1-(2-nitrophenoxy)butan-2-ylidene]hydroxylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.