2,3,5-Trichlorophenol
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CAS Number 933-78-8
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Catalog Number io-3150
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Classification Acids
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Molecular Weight 197.4000
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SMILES C1=C(C=C(C(=C1O)Cl)Cl)Cl
Size | QTY | Notes | |
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1 | 2,3,5-TRICHLOROPHENOL |
2 | Phenol, 2,3,5-trichloro- |
3 | 2,3,5-trichlorphenol |
4 | 6T7DUC2C8B |
5 | DTXSID0026208 |
Molecular Formula | C6H3Cl3O |
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Canonical SMILES | C1=C(C=C(C(=C1O)Cl)Cl)Cl |
Isomeric SMILES | C1=C(C=C(C(=C1O)Cl)Cl)Cl |
Molecular Weight | 197.4000 |
InChIKey | WWGQHTJIFOQAOC-UHFFFAOYSA-N |
InChI | InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H |
XLogP | 3.6000 |
ExactMass | 195.9249 |
MonoisotopicMass | 195.9249 |
TPSA | 20.2000 |
Complexity | 120.0000 |
Charge | 0.0000 |
HBondDonorCount | 1 |
HBondAcceptorCount | 1 |
RotatableBondCount | 0 |
HeavyAtomCount | 10 |
IsotopeAtomCount | 0 |
AtomStereoCount | 0 |
DefinedAtomStereoCount | 0 |
UndefinedAtomStereoCount | 0 |
BondStereoCount | 0 |
DefinedBondStereoCount | 0 |
UndefinedBondStereoCount | 0 |
CovalentUnitCount | 1 |
PatentCount | 544 |
PatentFamilyCount | 261 |
LiteratureCount | 105 |