![Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester structure](/static/products/1031/103145-59-1.webp)
Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester
TL;DR: Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester (CAS 103145-59-1) is a chemical compound with molecular formula C10H12N6O2 and molecular weight 248.10217 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[[azidomethyl(methyl)amino]diazenyl]benzoate
Also Known As: Benzoic acid, methyl ester, methyl 4-[[azidomethyl(methyl)amino]diazenyl]benzoate, Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester, Methyl 4-[(1E)-3-(azidomethyl)-3-methyltriaz-1-en-1-yl]benzoate, Benzoic acid, 4-(3-azidomethyl-3-methyl-1-triazenyl)-, methyl ester
Technical Specifications
| Molecular Formula | C10H12N6O2 |
| Molecular Weight | 248.10217 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 68.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 248.10217 Da |
| Heavy Atoms | 18 |
| Complexity | 344.0 |
| SMILES | CN(CN=[N+]=[N-])N=NC1=CC=C(C=C1)C(=O)OC |
| InChIKey | RQIGGPRWZKMUEX-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester
Property Insights of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester
The XLogP value of 4.2 indicates that Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester. Following Lipinski's Rule of Five, Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester?
The CAS number of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester is 103145-59-1.
What is the molecular formula of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester?
The molecular formula of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester is C10H12N6O2.
What is the molecular weight of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester?
The molecular weight of Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester is 248.10217 g/mol.
Where can I buy Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester?
You can request a quote for Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 4-[3-(azidomethyl)-3-methyl-1-triazenyl]-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.