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(Q82918128)
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English
1-{[(4-Bromophenyl)methyl]sulfanyl}-2,4-dinitrobenzene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
367.9466398679999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₉BrN₂O₄S
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canonical SMILES
C1=CC(=CC=C1CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Br
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Identifiers
InChI
InChI=1S/C13H9BrN2O4S/c14-10-3-1-9(2-4-10)8-21-13-6-5-11(15(17)18)7-12(13)16(19)20/h1-7H,8H2
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InChIKey
XAUHWVPGZZMXDG-UHFFFAOYSA-N
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CAS Registry Number
19552-11-5
1 reference
InChIKey
XAUHWVPGZZMXDG-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=19552-11-5
PubChem CID
271219
1 reference
matched by identifier from
InChIKey
InChIKey
XAUHWVPGZZMXDG-UHFFFAOYSA-N
UniChem compound ID
10137480
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30941331
1 reference
matched by identifier from
InChIKey
InChIKey
XAUHWVPGZZMXDG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID201369772
0 references
NSC number
114663
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