| CAS Number | 1173026-41-9 |
| Catalog Number | AG019UTH |
| Chemical Name | Sodium 1-benzyl-1H-imidazole-2-carboxylate |
| IUPAC Name | sodium;1-benzylimidazole-2-carboxylate |
| InChI | InChI=1S/C11H10N2O2.Na/c14-11(15)10-12-6-7-13(10)8-9-4-2-1-3-5-9;/h1-7H,8H2,(H,14,15);/q;+1/p-1 |
| InChI Key | XZVQBVVWLKRYCB-UHFFFAOYSA-M |
| MDL Number | MFCD11857952 |
| Molecular Formula | C11H9N2NaO2 |
| Molecular Weight | 224.1911 |
| SMILES | O=C(C1=NC=CN1CC2=CC=CC=C2)[O-].[Na+] |
| Synonyms | sodium 1-benzyl-1H-imidazole-2-carboxylate,
1173026-41-9,
AC1Q1V5S,
CTK5I4943,
AKOS023166399,
MCULE-4132315107,
NE15318,
EN300-42760,
Z444311442,
|
| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.195g/mol |
| Monoisotopic Mass | 224.056g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number