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

Modify Date: 2025-10-21 09:09:19

3-(azocan-1-ylmethyl)-5-nitro-1H-indole Structure
3-(azocan-1-ylmethyl)-5-nitro-1H-indole structure
Common Name 3-(azocan-1-ylmethyl)-5-nitro-1H-indole
CAS Number 101831-98-5 Molecular Weight 287.35700
Density 1.219g/cm3 Boiling Point 466ºC at 760mmHg
Molecular Formula C16H21N3O2 Melting Point N/A
MSDS N/A Flash Point 235.6ºC

 Names

Name 3-(azocan-1-ylmethyl)-5-nitro-1H-indole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.219g/cm3
Boiling Point 466ºC at 760mmHg
Molecular Formula C16H21N3O2
Molecular Weight 287.35700
Flash Point 235.6ºC
Exact Mass 287.16300
PSA 64.85000
LogP 4.30330
Vapour Pressure 7.34E-09mmHg at 25°C
Index of Refraction 1.63
InChIKey MSMUAQKPNKYOPC-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1ccc2[nH]cc(CN3CCCCCCC3)c2c1

 Synonyms

INDOLE,3-(HEXAHYDRO-1(2H)-AZOCINYLMETHYL)-5-NITRO
5-Nitro-3-(heptamethyleneiminomethyl)indole
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