(4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate
TL;DR: (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate (CAS 299405-70-2) is a chemical compound with molecular formula C17H13Cl2NO2 and molecular weight 333.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate
Also Known As: 4-phenyl-3-buten-2-one O-(2,4-dichlorobenzoyl)oxime, (4-phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate
| Molecular Formula | C17H13Cl2NO2 |
|---|---|
| Molecular Weight | 333.03 g/mol |
| LogP | 5.2395 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.03235 |
| Heavy Atoms | 22 |
| Complexity | 724.6937 |
Chemical Identifiers
| CAS Number | 299405-70-2 |
|---|---|
| SMILES | CC(=NOC(=O)C1=C(C=C(C=C1)Cl)Cl)C=CC2=CC=CC=C2 |
Product Overview
(4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate (CAS 299405-70-2), with molecular formula C17H13Cl2NO2 and molecular weight 333.03 g/mol. IUPAC: (4-phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate.
Chemical Property Profile of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate
Property Insights of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate
The XLogP value of 5.2395 indicates that (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate?
The CAS number of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate is 299405-70-2.
What is the molecular formula of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate?
The molecular formula of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate is C17H13Cl2NO2.
What is the molecular weight of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate?
The molecular weight of (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate is 333.03 g/mol.
Where can I buy (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate?
You can request a quote for (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Phenylbut-3-en-2-ylideneamino) 2,4-dichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.