1-(4-Bromo-3-hydroxythiophen-2-yl)-3-morpholinopropane-1,3-dione

HCID 59609971
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Basic information

Standard SMILES
O=C(CC(=O)N1CCOCC1)c1scc(Br)c1O
InChIKey
SOKVWPBUGIODFV-UHFFFAOYSA-N
Molecular formula
C11H12BrNO4S
Average molar mass
334.19 g/mol

Names & identifiers

Preferred name
1-(4-Bromo-3-hydroxythiophen-2-yl)-3-morpholinopropane-1,3-dione
IUPAC
1-(4-bromo-3-hydroxythiophen-2-yl)-3-morpholin-4-ylpropane-1,3-dione

Names & synonyms

SCHEMBL2852747SOKVWPBUGIODFV-UHFFFAOYSA-N1-(4-bromo-3-hydroxythiophen-2-yl)-3-morpholinopropane-1,3-dione

Database identifiers

PubChem CID
59609971

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
95.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
18

Related reactions

3 records
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Compound notes

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