2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid
TL;DR: 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid (CAS 120882-29-3) is a chemical compound with molecular formula C11H16N2O2S and molecular weight 240.09325 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzyl-3-(methylsulfonodiimidoyl)propanoic acid
Also Known As: 2-benzyl-3-(methylsulfonodiimidoyl)propanoic acid, 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid, (2S)-2-Benzyl-3-(S-methylsulfonodiimidoyl)propanoic acid, Benzenepropanoic acid, alpha-[(S-methylsulfonodiimidoyl)methyl]-, Benzenepropanoic acid, I+/--[(S-methylsulfonodiimidoyl)methyl]-
Technical Specifications
| Molecular Formula | C11H16N2O2S |
| Molecular Weight | 240.09325 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.09325 Da |
| Heavy Atoms | 16 |
| Complexity | 326.0 |
| SMILES | CS(=N)(=N)CC(CC1=CC=CC=C1)C(=O)O |
| InChIKey | FKHYVJWYNYZPCA-UHFFFAOYSA-N |
Product Description
Applications: 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid is a fine chemical identified by CAS number 120882-29-3 and the molecular formula C11H16N2O2S and a molecular weight of 240.09 g/mol. Synonyms include 2-benzyl-3-(methylsulfonodiimidoyl)propanoic acid and 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid
Property Insights of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid
The XLogP value of 3.7 indicates that 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid. Following Lipinski's Rule of Five, 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid?
The CAS number of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid is 120882-29-3.
What is the molecular formula of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid?
The molecular formula of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid is C11H16N2O2S.
What is the molecular weight of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid?
The molecular weight of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid is 240.09325 g/mol.
What are the applications of 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid?
2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid?
You can request a quote for 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Benzyl-3-(S-methanesulfonodiimidoyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.