1-苯基-1-丙酮肟
TL;DR: 1-苯基-1-丙酮肟 (CAS 2157-50-8) is a chemical compound with molecular formula C9H11NO and molecular weight 149.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-苯基-1-丙酮肟
N-(1-phenylpropylidene)hydroxylamine
Also Known As: 1-phenyl-1-propanone oxime, Propiophenone oxime, propiophenoneoxime, N-(1-phenylpropylidene)hydroxylamine, (E)-Propiophenone oxime
| Molecular Formula | C9H11NO |
|---|---|
| Molecular Weight | 149.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 149.08406 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 2157-50-8 |
|---|---|
| SMILES | CCC(=NO)C1=CC=CC=C1 |
| InChIKey | MDLJMYBJBOYUNJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-苯基-1-丙酮肟 (CAS 2157-50-8), with molecular formula C9H11NO and molecular weight 149.08 g/mol. IUPAC: N-(1-phenylpropylidene)hydroxylamine.
Chemical Property Profile of 1-苯基-1-丙酮肟
Property Insights of 1-苯基-1-丙酮肟
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-苯基-1-丙酮肟. With a topological polar surface area (TPSA) of 32.6 Ų, 1-苯基-1-丙酮肟 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-苯基-1-丙酮肟 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 1-苯基-1-丙酮肟?
The CAS number of 1-苯基-1-丙酮肟 is 2157-50-8.
What is the molecular formula of 1-苯基-1-丙酮肟?
The molecular formula of 1-苯基-1-丙酮肟 is C9H11NO.
What is the molecular weight of 1-苯基-1-丙酮肟?
The molecular weight of 1-苯基-1-丙酮肟 is 149.08 g/mol.
Where can I buy 1-苯基-1-丙酮肟?
You can request a quote for 1-苯基-1-丙酮肟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-苯基-1-丙酮肟?
Yes, KEHONG BIO provides custom synthesis services for 1-苯基-1-丙酮肟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.