Bendiocarb phenol
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CAS Number 22961-82-6
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Catalog Number io-1778
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Classification Ethers
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Molecular Weight 166.1700
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SMILES CC1(OC2=CC=CC(=C2O1)O)C
| Size | QTY | Notes | |
|---|---|---|---|
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No description available for this item
| 1 | Bendiocarb phenol |
| 2 | 2,2-dimethyl-2H-1,3-benzodioxol-4-ol |
| 3 | 2,2-Dimethyl-1,3-benzodioxol-4-ol |
| 4 | 1,3-Benzodioxol-4-ol, 2,2-dimethyl- |
| 5 | 2,2-DIMETHYLBENZO[1,3]DIOXOL-4-OL |
| Molecular Formula | C9H10O3 |
|---|---|
| Canonical SMILES | CC1(OC2=CC=CC(=C2O1)O)C |
| Isomeric SMILES | CC1(OC2=CC=CC(=C2O1)O)C |
| Molecular Weight | 166.1700 |
| InChIKey | CSSWBRMYHJVCPZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C9H10O3/c1-9(2)11-7-5-3-4-6(10)8(7)12-9/h3-5,10H,1-2H3 |
| XLogP | 1.8000 |
| ExactMass | 166.0630 |
| MonoisotopicMass | 166.0630 |
| TPSA | 38.7000 |
| Complexity | 179.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 1 |
| HBondAcceptorCount | 3 |
| RotatableBondCount | 0 |
| HeavyAtomCount | 12 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 146 |
| PatentFamilyCount | 61 |
| LiteratureCount | 2 |
