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6-Bromo-1-(phenylsulfonyl)-1H-indole-3-carbaldehyde

HCID 45926137
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Basic information

CAS
1092460-47-3
Standard SMILES
O=Cc1cn(S(=O)(=O)c2ccccc2)c2cc(Br)ccc12
InChIKey
ZLDSFFWDRRFLBK-UHFFFAOYSA-N
Molecular formula
C15H10BrNO3S
Average molar mass
364.2 g/mol
Monoisotopic mass
362.95648

Names & identifiers

Preferred name
6-Bromo-1-(phenylsulfonyl)-1H-indole-3-carbaldehyde
IUPAC
1-(benzenesulfonyl)-6-bromoindole-3-carbaldehyde
English name
6-Bromo-1-(phenylsulfonyl)-1H-indole-3-carbaldehyde
Molecular formula
C15H10BrNO3S
Molecular weight
364.21

Names & synonyms

6-BROMO-1-(PHENYLSULFONYL)-1H-INDOLE-3-CARBALDEHYDE1092460-47-3MFCD115018981-(benzenesulfonyl)-6-bromoindole-3-carbaldehyde1-(benzenesulfonyl)-6-bromo-1H-indole-3-carbaldehydeC15H10BrNO3SDTXSID201216400AR3461AKOS027334995AS-45614CS-01728681-(benzenesulfonyl)-6-bromo-indole-3-carbaldehyde
Show more names
1H-Indole-3-carboxaldehyde, 6-bromo-1-(phenylsulfonyl)-
F3065176-Bromo-1-(phenylsulfonyl)-1H-indole-3-carboxaldehyde

Database identifiers

CAS
1092460-47-3
PubChem CID
45926137
DTXSID
DTXSID201216400

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
64.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
484

Related reactions

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Compound notes

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