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5-Bromo-6-chloroindoline-2,3-dione

HCID 178536645
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Basic information

CAS
259667-43-1
Standard SMILES
O=C1Nc2cc(Cl)c(Br)cc2C1=O
InChIKey
CBTNJOAZPMPZDZ-UHFFFAOYSA-N
Molecular formula
C8H3BrClNO2
Average molar mass
260.47 g/mol
Monoisotopic mass
258.90357

Names & identifiers

Preferred name
5-Bromo-6-chloroindoline-2,3-dione
IUPAC
5-bromo-6-chloro-1H-indole-2,3-dione
English name
5-Bromo-6-chloro-1H-indole-2,3-dione
Molecular formula
C8H3BrClNO2
Molecular weight
260.47

Names & synonyms

259667-43-15-Bromo-6-chloroindoline-2,3-dione5-bromo-6-chloro-1H-indole-2,3-dioneMFCD064090695-bromo-6-chloro-2,3-dihydro-1H-indole-2,3-dione5-bromo-6-chloroisatin1H-Indole-2,3-dione, 5-bromo-6-chloro-SCHEMBL1133657JKA667435-bromo-6-chloro-indoline-2,3-dioneAKOS024255965CS-W000674
Show more names
SB642005-Bromo-6-Chloro-1H-Indole-23-DioneAS-48605SY161778EN300-171185F51903F533120Z1269218459

Database identifiers

CAS
259667-43-1
PubChem CID
18518621

Properties

Computed structural propertiesFilling in

XLogP
2.1
Topological polar surface area
46.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
271

Physicochemical properties

Density
1.919 · 1.919±0.06 g/cm3(Predicted)
storage temp.
Store at room temperature
pka
7.72 · 7.72±0.20(Predicted)
Appearance
Yellow to orange Solid

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Compound notes

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