+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 15O | ||
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Name | Name: Wikipedia | Wikipedia - 1-Chloronaphthalene: 1-Chloronaphthalene is an aromatic compound. It is a colorless, oily liquid which may be used to determine the refractive index of crystals by immersion. The compound is an isomer to 2-chloronaphthalene.
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-Chemical information
Composition | Formula: C10H7Cl / Number of atoms: 18 / Formula weight: 162.616 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 15O / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4HJL | ||||
History |
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External links | UniChem / BindingDB / Brenda / ChEMBL / ChemicalBook / CompTox / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.6 | |
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-PDB entries
Showing all 1 items
PDB-4hjl:
Naphthalene 1,2-Dioxygenase bound to 1-chloronaphthalene