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English
(4S)-5,6-Dibromo-1,1-dimethoxy-4-methylhexane
group of stereoisomers with the chemical formula C₉H₁₈Br₂O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
315.96735401599994
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₈Br₂O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COC(CCC(C)C(Br)CBr)OC
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC(CC[C@H](C)C(Br)CBr)OC
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H18Br2O2/c1-7(8(11)6-10)4-5-9(12-2)13-3/h7-9H,4-6H2,1-3H3/t7-,8?/m0/s1
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InChIKey
KJGHFXVNZDJEOT-JAMMHHFISA-N
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CAS Registry Number
646994-40-3
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PubChem CID
71379141
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
60501634
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30801729
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DSSTOX compound identifier
DTXCID60752472
0 references
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