4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde
TL;DR: 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde (CAS 674-97-5) is a chemical compound with molecular formula C12H9NO5 and molecular weight 247.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dioxopyrrolidin-1-yl) 4-formylbenzoate
Also Known As: Ald-Ph-NHS ester, 2,5-Dioxopyrrolidin-1-yl 4-formylbenzoate, N-Succinimidyl 4-formylbenzoate, succinimidyl 4-formylbenzoate, SFBc
| Molecular Formula | C12H9NO5 |
|---|---|
| Molecular Weight | 247.05 g/mol |
| LogP | 0.7199 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.04807 |
| Heavy Atoms | 18 |
| Complexity | 503.77423 |
Chemical Identifiers
| CAS Number | 674-97-5 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)OC(=O)C2=CC=C(C=C2)C=O |
Product Overview
4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde (CAS 674-97-5), with molecular formula C12H9NO5 and molecular weight 247.05 g/mol. IUPAC: (2,5-dioxopyrrolidin-1-yl) 4-formylbenzoate.
Chemical Property Profile of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde
Property Insights of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde
The XLogP value of 0.7199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde. Following Lipinski's Rule of Five, 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde has 0 hydrogen bond donor(s) and 5 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 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde?
The CAS number of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde is 674-97-5.
What is the molecular formula of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde?
The molecular formula of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde is C12H9NO5.
What is the molecular weight of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde?
The molecular weight of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde is 247.05 g/mol.
Where can I buy 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde?
You can request a quote for 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.