4-Bromo-1-(2-methyl-benzenesulfonyl)-1H-indole

HCID 22015334
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Basic information

CAS
412048-78-3
Standard SMILES
Cc1ccccc1S(=O)(=O)n1ccc2c(Br)cccc21
InChIKey
DLGYNPROORIVRG-UHFFFAOYSA-N
Molecular formula
C15H12BrNO2S
Average molar mass
350.2 g/mol
Monoisotopic mass
348.97721172

Names & identifiers

Preferred name
4-Bromo-1-(2-methyl-benzenesulfonyl)-1H-indole
IUPAC
4-bromo-1-(2-methylphenyl)sulfonylindole
English name
4-bromo-1-(2-methyl-benzenesulfonyl)-1H-indole
Molecular formula
C15H12BrNO2S
Molecular weight
350.23

Names & synonyms

4-Bromo-1-[(2-methylphenyl)sulfonyl]-1H-indole4-Bromo-1-(2-methyl-benzenesulfonyl)-1H-indole412048-78-3SCHEMBL3625322DLGYNPROORIVRG-UHFFFAOYSA-NDTXSID5012501504-Bromo-1-(2-methylbenzene-1-sulfonyl)-1H-indole1H-Indole, 4-bromo-1-[(2-methylphenyl)sulfonyl]-

Database identifiers

CAS
412048-78-3
PubChem CID
22015334
DTXSID
DTXSID501250150

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
47.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
20

Physicochemical properties

Boiling point
508.8 · 508.8±52.0 °C(Predicted)
Density
1.51 · 1.51±0.1 g/cm3(Predicted)

Chemistry & industry

Suppliers1 total

上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]

Related reactions

16 records
New reaction record

Compound notes

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