CYI
CYCLOHEXYL ISOCYANIDE
Created: | 2005-07-15 |
Last modified: | 2011-06-04 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 19 |
Chiral Atom Count | 0 |
Bond Count | 19 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | CYCLOHEXYL ISOCYANIDE |
Systematic Name (OpenEye OEToolkits) | isocyanocyclohexane |
Formula | C7 H11 N |
Molecular Weight | 109.169 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | isocyanocyclohexane |
SMILES | CACTVS | 3.341 | [C-]#[N+]C1CCCCC1 |
SMILES | OpenEye OEToolkits | 1.5.0 | [C-]#[N+]C1CCCCC1 |
Canonical SMILES | CACTVS | 3.341 | [C-]#[N+]C1CCCCC1 |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | [C-]#[N+]C1CCCCC1 |
InChI | InChI | 1.03 | InChI=1S/C7H11N/c1-8-7-5-3-2-4-6-7/h7H,2-6H2 |
InChIKey | InChI | 1.03 | XYZMOVWWVXBHDP-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 79129 |
ChEBI | CHEBI:17966 |