p-Methylbenzaldoxime
TL;DR: p-Methylbenzaldoxime (CAS 3717-16-6) is a chemical compound with molecular formula C8H9NO and molecular weight 135.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NZ)-N-[(4-methylphenyl)methylidene]hydroxylamine
Also Known As: p-Methylbenzaldoxime, anti-p-Tolualdoxime, 4-Methylbenzaldehyde oxime, p-Methyl-anti-benzaloxime, (4-Methylbenzaldehyde oxime
| Molecular Formula | C8H9NO |
|---|---|
| Molecular Weight | 135.07 g/mol |
| LogP | 1.80312 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 135.06842 |
| Heavy Atoms | 10 |
| Complexity | 225.51784 |
Chemical Identifiers
| CAS Number | 3717-16-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=N\O |
Product Overview
p-Methylbenzaldoxime (CAS 3717-16-6), with molecular formula C8H9NO and molecular weight 135.07 g/mol. IUPAC: (NZ)-N-[(4-methylphenyl)methylidene]hydroxylamine.
Chemical Property Profile of p-Methylbenzaldoxime
Property Insights of p-Methylbenzaldoxime
The XLogP value of 1.80312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Methylbenzaldoxime. With a topological polar surface area (TPSA) of 32.59 Ų, p-Methylbenzaldoxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Methylbenzaldoxime has 1 hydrogen bond donor(s) and 2 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 p-Methylbenzaldoxime?
The CAS number of p-Methylbenzaldoxime is 3717-16-6.
What is the molecular formula of p-Methylbenzaldoxime?
The molecular formula of p-Methylbenzaldoxime is C8H9NO.
What is the molecular weight of p-Methylbenzaldoxime?
The molecular weight of p-Methylbenzaldoxime is 135.07 g/mol.
Where can I buy p-Methylbenzaldoxime?
You can request a quote for p-Methylbenzaldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Methylbenzaldoxime?
Yes, KEHONG BIO provides custom synthesis services for p-Methylbenzaldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.