1,3-Dichloropropylene
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CAS Number 542-75-6
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Catalog Number io-2192
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Classification Halogenated Organic Compounds
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Molecular Weight 110.9700
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SMILES C(C=CCl)Cl
| Size | QTY | Notes | |
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1,3-Dichloropropene can cause cancer according to an independent committee of scientific and health experts.
| 1 | 1,3-Dichloro-1-propene |
| 2 | 1,3-Dichloropropene |
| 3 | 1, 3-Dichloropropene |
| 4 | DTXSID1022057 |
| 5 | 1,3 dichloropropene |
| Molecular Formula | C3H4Cl2 |
|---|---|
| Canonical SMILES | C(C=CCl)Cl |
| Isomeric SMILES | C(C=CCl)Cl |
| Molecular Weight | 110.9700 |
| InChIKey | UOORRWUZONOOLO-UHFFFAOYSA-N |
| InChI | InChI=1S/C3H4Cl2/c4-2-1-3-5/h1-2H,3H2 |
| XLogP | 1.7000 |
| ExactMass | 109.9690 |
| MonoisotopicMass | 109.9690 |
| TPSA | 0.0000 |
| Complexity | 31.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 0 |
| RotatableBondCount | 1 |
| HeavyAtomCount | 5 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 1 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 1 |
| CovalentUnitCount | 1 |
| PatentCount | 12543 |
| PatentFamilyCount | 4304 |
| LiteratureCount | 469 |
