4'-Nitro-5'-(picrylamino)benzo-18-crown-6

CAS

74305-50-3

Catalog Number

ACM74305503

Category

Other Products

Molecular Weight

583.46

Molecular Formula

C₂₂H₂₅N₅O₁₄

MSDS COA Spec Sheet

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Specification

Synonyms

4'-NITRO-5'-(PICRYLAMINO)BENZO-18-CROWN-6;TAKAGI'S REAGENT;4'-NITRO-5'-(PICRYLAMINO)BENZO- &;3-Nitro-4-(2,4,6-trinitrophenylamino)-benzo-18-crown-6

IUPAC Name

20-nitro-N-(2,4,6-trinitrophenyl)-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-21-amine

Canonical SMILES

C1COCCOCCOC2=C(C=C(C(=C2)[N+](=O)[O-])NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])OCCOCCO1

InChI Key

FAUKOFGGYQDNKF-UHFFFAOYSA-N

Melting Point

185-188ºC

Exact Mass

583.14000

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

26-36

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