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English
[3-acetyloxy-5-(5-bromo-5-fluoro-6-methoxy-2,4-dioxo-1,3-diazinan-1-yl)oxolan-2-yl]methyl acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
440.023055856
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₈BrFN₂O₈
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COC1N(C2CC(OC(C)=O)C(COC(C)=O)O2)C(=O)NC(=O)C1(F)Br
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C14H18BrFN2O8/c1-6(19)24-5-9-8(25-7(2)20)4-10(26-9)18-12(23-3)14(15,16)11(21)17-13(18)22/h8-10,12H,4-5H2,1-3H3,(H,17,21,22)
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InChIKey
XGWIIXCFLJKFNL-UHFFFAOYSA-N
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CAS Registry Number
7771-05-3
0 references
PubChem CID
352788
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
62396052
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40326433
0 references
DSSTOX compound identifier
DTXCID30277546
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NSC number
527965
0 references
528898
0 references
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