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(Q82948095)
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English
2-(tert-Butylamino)-1-(5-chlorothiophen-2-yl)ethan-1-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
233.064112812
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₀H₁₆ClNOS
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)(C)NCC(O)c1ccc(Cl)s1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C10H16ClNOS/c1-10(2,3)12-6-7(13)8-4-5-9(11)14-8/h4-5,7,12-13H,6H2,1-3H3
0 references
InChIKey
BOTOLKNNLXDWAG-UHFFFAOYSA-N
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CAS Registry Number
51452-63-2
0 references
PubChem CID
3039980
1 reference
matched by identifier from
InChIKey
InChIKey
BOTOLKNNLXDWAG-UHFFFAOYSA-N
DSSTox substance ID
DTXSID80965784
1 reference
matched by identifier from
InChIKey
InChIKey
BOTOLKNNLXDWAG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID101393443
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