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152560

BDPA complex with benzene(1:1), free radical

Synonym(s):

α,γ-Bisdiphenylene-β-phenylallyl

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About This Item

Empirical Formula (Hill Notation):
C39H27
CAS Number:
35585-94-5
Molecular Weight:
495.63
NACRES:
NA.22
PubChem Substance ID:
24849237
UNSPSC Code:
12352000
MDL number:
MFCD00001160
Form:
solid
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form

solid

Quality Level

100

mp

210 °C (dec.) (lit.)

SMILES string

C1(C([C]2C(C=CC=C3)=C3C4=C2C=CC=C4)=C5C(C=CC=C6)=C6C7=C5C=CC=C7)=CC=CC=C1.C8=CC=CC=C8

InChI

1S/C33H21.C6H6/c1-2-12-22(13-3-1)31(32-27-18-8-4-14-23(27)24-15-5-9-19-28(24)32)33-29-20-10-6-16-25(29)26-17-7-11-21-30(26)33;1-2-4-6-5-3-1/h1-21H;1-6H

InChI key

JLJWIVHYUCBSRC-UHFFFAOYSA-N

General description

BDPA complex with benzene (1:1) is a stable organic radical commonly employed in dynamic nuclear polarization NMR studies.

Application

BDPA complex with benzene (1:1), free radical is used to study the antiradical activities of some flavonols, flavones, flavanones, and flavan-3-ols.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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Certificates of Analysis (COA)

Lot/Batch Number
00226KM

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Kinetic study of flavonoid reactions with stable radicals
Butkovic V, et al.
Journal of Agricultural and Food Chemistry, 52(10), 2816-2820 (2004)
Electron spin relaxation and heterogeneity of the 1:1 ?,?-bisdiphenylene-?-phenylallyl (BDPA)/benzene complex
Mitchell DG, et al.
The Journal of Physical Chemistry B, 115(24), 7986-7990 (2011)

Global Trade Item Number

SKUGTIN
152560-100MG04061838740403