1-(chloromethyl)-4-aza-1-azoniabicyclo[2.2.2]octane (Q82271197)

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chemical compound

• 4-Aza-1-azoniabicyclo[2.2.2]octane, 1-(chloromethyl)-

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Language	Label	Description	Also known as
English	1-(chloromethyl)-4-aza-1-azoniabicyclo[2.2.2]octane	chemical compound	4-Aza-1-azoniabicyclo[2.2.2]octane, 1-(chloromethyl)-

Statements

instance of

type of chemical entity

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subclass of

chemical compound

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chemical structure

1-(Chloromethyl)-1,4-diazabicyclo(2.2.2)octan-1-ium.svg
210 × 285; 8 KB

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mass

161.08400254808998 dalton

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based on heuristic

inferred from InChI

chemical formula

C₇H₁₄ClN₂⁺

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based on heuristic

inferred from SMILES

canonical SMILES

C1C[N+]2(CCN1CC2)CCl

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Identifiers

InChI

InChI=1S/C7H14ClN2/c8-7-10-4-1-9(2-5-10)3-6-10/h1-7H2/q+1

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InChIKey

XXCCIDBYUOUQSL-UHFFFAOYSA-N

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CAS Registry Number

93645-58-0

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PubChem CID

10997945

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matched by identifier from

InChIKey

InChIKey

XXCCIDBYUOUQSL-UHFFFAOYSA-N

SureChEMBL ID

SCHEMBL1908676

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

XXCCIDBYUOUQSL-UHFFFAOYSA-N

UniChem compound ID

26893785

1 reference

stated in

UniChem

DSSTox substance ID

DTXSID50451260

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matched by identifier from

InChIKey

InChIKey

XXCCIDBYUOUQSL-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID80197806

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Wikivoyage(0 entries)

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