(Hydroxyimino)(1-methylpyrazol-4-yl)methane
TL;DR: (Hydroxyimino)(1-methylpyrazol-4-yl)methane (CAS 42849-80-9) is a chemical compound with molecular formula C5H7N3O and molecular weight 125.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-[(1-methylpyrazol-4-yl)methylidene]hydroxylamine
Also Known As: (hydroxyimino)(1-methylpyrazol-4-yl)methane, 1-Methyl-1H-pyrazole-4-carbaldehyde oxime, N-[(1-methyl-1H-pyrazol-4-yl)methylidene]hydroxylamine, (4E)-1-methylpyrazole-4-carbaldehyde oxime, (NE)-N-[(1-methylpyrazol-4-yl)methylidene]hydroxylamine
| Molecular Formula | C5H7N3O |
|---|---|
| Molecular Weight | 125.06 g/mol |
| LogP | 0.2282 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.058914 |
| Heavy Atoms | 9 |
| Complexity | 215.73262 |
Chemical Identifiers
| CAS Number | 42849-80-9 |
|---|---|
| SMILES | CN1C=C(C=N1)/C=N/O |
Product Overview
(Hydroxyimino)(1-methylpyrazol-4-yl)methane (CAS 42849-80-9), with molecular formula C5H7N3O and molecular weight 125.06 g/mol. IUPAC: (NE)-N-[(1-methylpyrazol-4-yl)methylidene]hydroxylamine.
Chemical Property Profile of (Hydroxyimino)(1-methylpyrazol-4-yl)methane
Property Insights of (Hydroxyimino)(1-methylpyrazol-4-yl)methane
The XLogP value of 0.2282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Hydroxyimino)(1-methylpyrazol-4-yl)methane. With a topological polar surface area (TPSA) of 50.41 Ų, (Hydroxyimino)(1-methylpyrazol-4-yl)methane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Hydroxyimino)(1-methylpyrazol-4-yl)methane has 1 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 (Hydroxyimino)(1-methylpyrazol-4-yl)methane?
The CAS number of (Hydroxyimino)(1-methylpyrazol-4-yl)methane is 42849-80-9.
What is the molecular formula of (Hydroxyimino)(1-methylpyrazol-4-yl)methane?
The molecular formula of (Hydroxyimino)(1-methylpyrazol-4-yl)methane is C5H7N3O.
What is the molecular weight of (Hydroxyimino)(1-methylpyrazol-4-yl)methane?
The molecular weight of (Hydroxyimino)(1-methylpyrazol-4-yl)methane is 125.06 g/mol.
Where can I buy (Hydroxyimino)(1-methylpyrazol-4-yl)methane?
You can request a quote for (Hydroxyimino)(1-methylpyrazol-4-yl)methane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Hydroxyimino)(1-methylpyrazol-4-yl)methane?
Yes, KEHONG BIO provides custom synthesis services for (Hydroxyimino)(1-methylpyrazol-4-yl)methane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.