Anilazine
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CAS Number 101-05-3
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Catalog Number io-1734
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Classification Amines
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Molecular Weight 275.5000
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SMILES C1=CC=C(C(=C1)NC2=NC(=NC(=N2)Cl)Cl)Cl
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Anilazine is a member of the class of triazenes that is dichlorotriazene in which the hydrogen is replaced by an o-chloroanilino group. A fungicide formerly used to control leaf spots and downy mildew, it is no longer approved for use within the European Union. It has a role as an antifungal agrochemical. It is a member of triazines, an organochlorine pesticide, a secondary amino compound and a member of monochlorobenzenes.
1 | Anilazine |
2 | DYRENE |
3 | Anilazin |
4 | Zinochlor |
5 | Kemate |
Molecular Formula | C9H5Cl3N4 |
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Canonical SMILES | C1=CC=C(C(=C1)NC2=NC(=NC(=N2)Cl)Cl)Cl |
Isomeric SMILES | C1=CC=C(C(=C1)NC2=NC(=NC(=N2)Cl)Cl)Cl |
Molecular Weight | 275.5000 |
InChIKey | IMHBYKMAHXWHRP-UHFFFAOYSA-N |
InChI | InChI=1S/C9H5Cl3N4/c10-5-3-1-2-4-6(5)13-9-15-7(11)14-8(12)16-9/h1-4H,(H,13,14,15,16) |
XLogP | 3.0000 |
ExactMass | 273.9580 |
MonoisotopicMass | 273.9580 |
TPSA | 50.7000 |
Complexity | 221.0000 |
Charge | 0.0000 |
HBondDonorCount | 1 |
HBondAcceptorCount | 4 |
RotatableBondCount | 2 |
HeavyAtomCount | 16 |
IsotopeAtomCount | 0 |
AtomStereoCount | 0 |
DefinedAtomStereoCount | 0 |
UndefinedAtomStereoCount | 0 |
BondStereoCount | 0 |
DefinedBondStereoCount | 0 |
UndefinedBondStereoCount | 0 |
CovalentUnitCount | 1 |
PatentCount | 154942 |
PatentFamilyCount | 60617 |
LiteratureCount | 212 |