(E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine
TL;DR: (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine (CAS 956979-23-0) is a chemical compound with molecular formula C8H13N3O and molecular weight 167.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-[(3-methyl-1-propylpyrazol-4-yl)methylidene]hydroxylamine
Also Known As: (E)-3-methyl-1-propyl-1H-pyrazole-4-carbaldehyde oxime, (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine, (NE)-N-[(3-methyl-1-propylpyrazol-4-yl)methylidene]hydroxylamine, (E)-N-[(3-METHYL-1-PROPYL-1H-PYRAZOL-4-YL)METHYLIDENE]HYDROXYLAMINE
| Molecular Formula | C8H13N3O |
|---|---|
| Molecular Weight | 167.11 g/mol |
| LogP | 1.40962 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.10587 |
| Heavy Atoms | 12 |
| Complexity | 277.83038 |
Chemical Identifiers
| CAS Number | 956979-23-0 |
|---|---|
| SMILES | CCCN1C=C(C(=N1)C)/C=N/O |
Product Overview
(E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine (CAS 956979-23-0), with molecular formula C8H13N3O and molecular weight 167.11 g/mol. IUPAC: (NE)-N-[(3-methyl-1-propylpyrazol-4-yl)methylidene]hydroxylamine.
Chemical Property Profile of (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine
Property Insights of (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine
The XLogP value of 1.40962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine. With a topological polar surface area (TPSA) of 50.41 Ų, (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine 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 (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine?
The CAS number of (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine is 956979-23-0.
What is the molecular formula of (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine?
The molecular formula of (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine is C8H13N3O.
What is the molecular weight of (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine?
The molecular weight of (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine is 167.11 g/mol.
Where can I buy (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine?
You can request a quote for (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-hydroxy-1-(3-methyl-1-propyl-1H-pyrazol-4-yl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.