Indole, 3-(hexahydro-1(2H)-azocinylmethyl)-5-nitro-

3-(azocan-1-ylmethyl)-5-nitro-1H-indole

CAS: 101831-98-5

Molecular Formula	`C16H21N3O2`
Molecular Weight	287.1634 g/mol
LogP	3.84
Topological Polar Surface Area	62.17 Å²
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	287.1634
Heavy Atoms	21
Complexity	627.5

Chemical Identifiers

CAS Number	101831-98-5
SMILES	`C1CCCN(CCC1)CC2=CNC3=C2C=C(C=C3)[N+](=O)[O-]`

Product Overview

Indole, 3-(hexahydro-1(2H)-azocinylmethyl)-5-nitro- (CAS 101831-98-5), with molecular formula C16H21N3O2 and molecular weight 287.1634 g/mol. IUPAC: 3-(azocan-1-ylmethyl)-5-nitro-1H-indole.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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