Chemical Name - Iodoacetic acid, sodium salt
Mol Weight - 184.936
Smiles - [O-]C(CI)=O.[Na+]
Mol Weight - 184.936
Smiles - [O-]C(CI)=O.[Na+]
| Property Value | |
| Mol Name | Iodoacetic acid, sodium salt |
| Molweight | 184.936 |
| Monoisotopic Mass | 184.909953 |
| Clogp | -1.7624 |
| Clogs | -0.583 |
| H Acceptors | 2 |
| Total Surface Area | 78.82 |
| Relative Psa | 0.34661 |
| Polar Surface Area | 40.13 |
| Druglikeness | -3.8485 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.8 |
| Molecular Flexibility | 0.61655 |
| Molecular Complexity | 0.69315 |
| Fragments | 2 |
| Non H Atoms | 5 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 1 |
| Sp3 Atoms | 2 |
| Acidic Oxygens | 1 |
| Smiles | [O-]C(CI)=O.[Na+] |
| InChIKey | InChI=1S/C2H3IO2.Na/c3-1-2(4)5;/h1H2,(H,4,5);/q;+1/p-1 |
| InChI | AGDSCTQQXMDDCV-UHFFFAOYSA-M |
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1 - Iodoacetic acid, sodium salt
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1 - Iodoacetic acid, sodium salt
2 - Iodoacetic acid, sodium salt
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