(Q82544197)

English

Lithium (cyclooctane-1,5-diyl-kappa~2~C~1~,C~5~)(hydrido)[(1R,2S,3R,5R)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-yl]borate(1-)

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Statements

type of chemical entity

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chemical compound

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265.267885942 dalton

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based on heuristic

inferred from SMILES

stereoisomer of

S-Alpine-Hydride

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based on heuristic

inferred from InChI

chemical formula

C₁₈H₃₁BLi

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based on heuristic

inferred from SMILES

canonical SMILES

CC1C([B-]2C3CCCC2CCC3)CC2CC1C2(C)C.[Li+]

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C[C@@H]1[C@H]2C[C@@H](C[C@H]1[B-]1C3CCCC1CCC3)C2(C)C.[Li+]

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C18H31B.Li/c1-12-16-10-13(18(16,2)3)11-17(12)19-14-6-4-7-15(19)9-5-8-14;/h12-17H,4-11H2,1-3H3;/q-1;+1/t12-,13+,14?,15?,16-,17-;/m1./s1

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MYYWMZXHGVQUHN-UJMFPOEGSA-N

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CAS Registry Number

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26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

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