Acifluorfen-sodium
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CAS Number 62476-59-9
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Catalog Number io-1670
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Classification Aryl Halides
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Molecular Weight 383.6400
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SMILES C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-].[Na+]
| Size | QTY | Notes | |
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Acifluorfen Sodium can cause cancer according to The Environmental Protection Agency (EPA).
| 1 | Acifluorfen sodium |
| 2 | ACIFLUORFEN-SODIUM |
| 3 | Scifluorfen |
| 4 | Sodium 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoate |
| 5 | Sodium Acifluorfen |
| Molecular Formula | C14H6ClF3NNaO5 |
|---|---|
| Canonical SMILES | C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-].[Na+] |
| Isomeric SMILES | C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-].[Na+] |
| Molecular Weight | 383.6400 |
| InChIKey | RVULBHWZFCBODE-UHFFFAOYSA-M |
| InChI | InChI=1S/C14H7ClF3NO5.Na/c15-10-5-7(14(16,17)18)1-4-12(10)24-8-2-3-11(19(22)23)9(6-8)13(20)21;/h1-6H,(H,20,21);/q;+1/p-1 |
| XLogP | 0.0000 |
| ExactMass | 382.9784 |
| MonoisotopicMass | 382.9784 |
| TPSA | 95.2000 |
| Complexity | 479.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 8 |
| RotatableBondCount | 2 |
| HeavyAtomCount | 25 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 2 |
| PatentCount | 9359 |
| PatentFamilyCount | 2203 |
| LiteratureCount | 116 |
