2-(6-Bromo-benzothiazol-2-yl)-ethanol

HCID 21980076
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Basic information

Standard SMILES
OCCc1nc2ccc(Br)cc2s1
InChIKey
DNZNDQBGXCCJMI-UHFFFAOYSA-N
Molecular formula
C9H8BrNOS
Average molar mass
258.14 g/mol

Names & identifiers

Preferred name
2-(6-Bromo-benzothiazol-2-yl)-ethanol
IUPAC
2-(6-bromo-1,3-benzothiazol-2-yl)ethanol

Names & synonyms

SCHEMBL489018DNZNDQBGXCCJMI-UHFFFAOYSA-N2-(6-bromo-benzothiazol-2-yl)-ethanol

Database identifiers

PubChem CID
21980076

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
61.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
13

Related reactions

18 records
New reaction record

Compound notes

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