0QE
chloromethane
Created: | 2008-12-08 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 5 |
Chiral Atom Count | 0 |
Bond Count | 4 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | chloromethane |
Synonyms | Chloro Methyl group |
Systematic Name (OpenEye OEToolkits) | chloromethane |
Formula | C H3 Cl |
Molecular Weight | 50.488 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | ClC |
SMILES | CACTVS | 3.370 | CCl |
SMILES | OpenEye OEToolkits | 1.7.0 | CCl |
Canonical SMILES | CACTVS | 3.370 | CCl |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | CCl |
InChI | InChI | 1.03 | InChI=1S/CH3Cl/c1-2/h1H3 |
InChIKey | InChI | 1.03 | NEHMKBQYUWJMIP-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 6327 |
ChEMBL | CHEMBL117545 |
ChEBI | CHEBI:36014 |
CCDC/CSD | CLMETH, CLMETH03, CLMETH02, CLMETH04, FOGYIL, CLMETH01, ILUFIG01, ILUFIG |