O-(o-tolylcarbamoyl)butyrhydroximoyl chloride
TL;DR: O-(o-tolylcarbamoyl)butyrhydroximoyl chloride (CAS 145252-13-7) is a chemical compound with molecular formula C12H15ClN2O2 and molecular weight 254.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-chlorobutylideneamino) N-(2-methylphenyl)carbamate
Also Known As: O-(o-tolylcarbamoyl)butyrhydroximoyl chloride, (1-chlorobutylideneamino) N-(2-methylphenyl)carbamate, Butanimidoyl chloride,N-[[[(2-methylphenyl)amino]carbonyl]oxy]-, N-((((2-Methylphenyl)amino)carbonyl)oxy)butanimidoyl chloride, Butanimidoyl chloride, N-((((2-methylphenyl)amino)carbonyl)oxy)-
| Molecular Formula | C12H15ClN2O2 |
|---|---|
| Molecular Weight | 254.08 g/mol |
| LogP | 3.89592 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.0822 |
| Heavy Atoms | 17 |
| Complexity | 418.7216 |
Chemical Identifiers
| CAS Number | 145252-13-7 |
|---|---|
| SMILES | CCCC(=NOC(=O)NC1=CC=CC=C1C)Cl |
Product Overview
O-(o-tolylcarbamoyl)butyrhydroximoyl chloride (CAS 145252-13-7), with molecular formula C12H15ClN2O2 and molecular weight 254.08 g/mol. IUPAC: (1-chlorobutylideneamino) N-(2-methylphenyl)carbamate.
Chemical Property Profile of O-(o-tolylcarbamoyl)butyrhydroximoyl chloride
Property Insights of O-(o-tolylcarbamoyl)butyrhydroximoyl chloride
The XLogP value of 3.89592 indicates that O-(o-tolylcarbamoyl)butyrhydroximoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.69 Ų, O-(o-tolylcarbamoyl)butyrhydroximoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-(o-tolylcarbamoyl)butyrhydroximoyl chloride 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 O-(o-tolylcarbamoyl)butyrhydroximoyl chloride?
The CAS number of O-(o-tolylcarbamoyl)butyrhydroximoyl chloride is 145252-13-7.
What is the molecular formula of O-(o-tolylcarbamoyl)butyrhydroximoyl chloride?
The molecular formula of O-(o-tolylcarbamoyl)butyrhydroximoyl chloride is C12H15ClN2O2.
What is the molecular weight of O-(o-tolylcarbamoyl)butyrhydroximoyl chloride?
The molecular weight of O-(o-tolylcarbamoyl)butyrhydroximoyl chloride is 254.08 g/mol.
Where can I buy O-(o-tolylcarbamoyl)butyrhydroximoyl chloride?
You can request a quote for O-(o-tolylcarbamoyl)butyrhydroximoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-(o-tolylcarbamoyl)butyrhydroximoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for O-(o-tolylcarbamoyl)butyrhydroximoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.