2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime
TL;DR: 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime (CAS 354548-95-1) is a chemical compound with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-2,3-dihydrochromen-4-ylideneamino] 2-chlorobenzoate
Also Known As: 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime, [(Z)-2,3-dihydrochromen-4-ylideneamino] 2-chlorobenzoate
| Molecular Formula | C16H12ClNO3 |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | 3.6836 |
| Topological Polar Surface Area | 47.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.05057 |
| Heavy Atoms | 21 |
| Complexity | 712.1732 |
Chemical Identifiers
| CAS Number | 354548-95-1 |
|---|---|
| SMILES | C\1COC2=CC=CC=C2/C1=N\OC(=O)C3=CC=CC=C3Cl |
Product Overview
2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime (CAS 354548-95-1), with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol. IUPAC: [(Z)-2,3-dihydrochromen-4-ylideneamino] 2-chlorobenzoate.
Chemical Property Profile of 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime
Property Insights of 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime
The XLogP value of 3.6836 indicates that 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.89 Ų, 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime has 0 hydrogen bond donor(s) and 4 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 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime?
The CAS number of 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime is 354548-95-1.
What is the molecular formula of 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime?
The molecular formula of 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime is C16H12ClNO3.
What is the molecular weight of 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime?
The molecular weight of 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime is 301.05 g/mol.
Where can I buy 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime?
You can request a quote for 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 2,3-dihydro-4H-chromen-4-one O-(2-chlorobenzoyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.