5-Bromo-3-(2-methyl-2-nitropropyl)indole

HCID 12619661
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Basic information

Standard SMILES
CC(C)(Cc1c[nH]c2ccc(Br)cc12)[N+](=O)[O-]
InChIKey
NCJYHNBIFXMTLE-UHFFFAOYSA-N
Molecular formula
C12H13BrN2O2
Average molar mass
297.15 g/mol

Names & identifiers

Preferred name
5-Bromo-3-(2-methyl-2-nitropropyl)indole
IUPAC
5-bromo-3-(2-methyl-2-nitropropyl)-1H-indole

Names & synonyms

SCHEMBL10940809NCJYHNBIFXMTLE-UHFFFAOYSA-N5-Bromo-3-(2-methyl-2-nitropropyl)indole

Database identifiers

PubChem CID
12619661

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
61.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17

Related reactions

4 records
New reaction record

Linked notes

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