Chlorthiophos
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CAS Number 21923-23-9
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Catalog Number io-2001
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Classification Aryl Halides
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Molecular Weight 361.2000
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SMILES CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)SC)Cl
| Size | QTY | Notes | |
|---|---|---|---|
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Chlorthiophos is an organic thiophosphate.
| 1 | CHLORTHIOPHOS |
| 2 | Chlorthiophos I |
| 3 | Celathion |
| 4 | 60238-56-4 |
| 5 | Celamerck S-2957 |
| Molecular Formula | C11H15Cl2O3PS2 |
|---|---|
| Canonical SMILES | CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)SC)Cl |
| Isomeric SMILES | CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)SC)Cl |
| Molecular Weight | 361.2000 |
| InChIKey | JAZJVWLGNLCNDD-UHFFFAOYSA-N |
| InChI | InChI=1S/C11H15Cl2O3PS2/c1-4-14-17(18,15-5-2)16-10-6-9(13)11(19-3)7-8(10)12/h6-7H,4-5H2,1-3H3 |
| XLogP | 6.0000 |
| ExactMass | 359.9577 |
| MonoisotopicMass | 359.9577 |
| TPSA | 85.1000 |
| Complexity | 312.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 5 |
| RotatableBondCount | 7 |
| HeavyAtomCount | 19 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 3883 |
| PatentFamilyCount | 845 |
| LiteratureCount | 101 |
