Methyl 4-(2-diazoacetyl)benzoate
TL;DR: Methyl 4-(2-diazoacetyl)benzoate (CAS 22744-13-4) is a chemical compound with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(2-diazoacetyl)benzoate
Also Known As: NCIOpen2_005359, 4-(Diazoacetyl)benzoic acid methyl ester, METHYL 4-(2-DIAZOACETYL)BENZOATE, 4-(2-Diazoacetyl)benzoic acid methyl ester, J1.096.992A
| Molecular Formula | C10H8N2O3 |
|---|---|
| Molecular Weight | 204.05 g/mol |
| LogP | 0.9565 |
| Topological Polar Surface Area | 79.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.0535 |
| Heavy Atoms | 15 |
| Complexity | 430.48566 |
Chemical Identifiers
| CAS Number | 22744-13-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C(=O)C=[N+]=[N-] |
Product Overview
Methyl 4-(2-diazoacetyl)benzoate (CAS 22744-13-4), with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol. IUPAC: methyl 4-(2-diazoacetyl)benzoate.
Chemical Property Profile of Methyl 4-(2-diazoacetyl)benzoate
Property Insights of Methyl 4-(2-diazoacetyl)benzoate
The XLogP value of 0.9565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(2-diazoacetyl)benzoate. The TPSA of 79.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(2-diazoacetyl)benzoate. Following Lipinski's Rule of Five, Methyl 4-(2-diazoacetyl)benzoate has 0 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 Methyl 4-(2-diazoacetyl)benzoate?
The CAS number of Methyl 4-(2-diazoacetyl)benzoate is 22744-13-4.
What is the molecular formula of Methyl 4-(2-diazoacetyl)benzoate?
The molecular formula of Methyl 4-(2-diazoacetyl)benzoate is C10H8N2O3.
What is the molecular weight of Methyl 4-(2-diazoacetyl)benzoate?
The molecular weight of Methyl 4-(2-diazoacetyl)benzoate is 204.05 g/mol.
Where can I buy Methyl 4-(2-diazoacetyl)benzoate?
You can request a quote for Methyl 4-(2-diazoacetyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(2-diazoacetyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(2-diazoacetyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.