3-(2-Nitro-2-methylpropyl)-7-nitroindole

HCID 22014767
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Basic information

Standard SMILES
CC(C)(Cc1c[nH]c2c([N+](=O)[O-])cccc12)[N+](=O)[O-]
InChIKey
PHKFAUMCHJYWSD-UHFFFAOYSA-N
Molecular formula
C12H13N3O4
Average molar mass
263.25 g/mol

Names & identifiers

Preferred name
3-(2-Nitro-2-methylpropyl)-7-nitroindole
IUPAC
3-(2-methyl-2-nitropropyl)-7-nitro-1H-indole

Names & synonyms

SCHEMBL5648910PHKFAUMCHJYWSD-UHFFFAOYSA-N3-(2-Nitro-2-methylpropyl)-7-nitroindole

Database identifiers

PubChem CID
22014767

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
107 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
19

Related reactions

7 records
New reaction record

Linked notes

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