69772
Michler′s ketone
purum, ≥96.0% (NT)
Synonym(s):
4,4′-Bis(dimethylamino)benzophenone
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About This Item
Linear Formula:
[(CH3)2NC6H4]2CO
CAS Number:
Molecular Weight:
268.35
Beilstein:
790733
EC Number:
MDL number:
UNSPSC Code:
12352103
grade
purum
Assay
≥96.0% (NT)
mp
172-175 °C
174-176 °C (lit.)
SMILES string
CN(C)c1ccc(cc1)C(=O)c2ccc(cc2)N(C)C
InChI
1S/C17H20N2O/c1-18(2)15-9-5-13(6-10-15)17(20)14-7-11-16(12-8-14)19(3)4/h5-12H,1-4H3
InChI key
VVBLNCFGVYUYGU-UHFFFAOYSA-N
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Control of hepatitis C: a medicinal chemistry perspective.
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A dataset comprising 55 chemicals with hepatocarcinogenic potency indices was collected from the Carcinogenic Potency Database with the aim of developing QSAR models enabling prediction of the above unwanted property for New Chemical Entities. The dataset was rationally split into
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