310999
2,6-Dicyanotoluene
97%
Synonym(s):
2-Methyl-1,3-benzenedicarbonitrile
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About This Item
Linear Formula:
CH3C6H3(CN)2
CAS Number:
Molecular Weight:
142.16
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
InChI
1S/C9H6N2/c1-7-8(5-10)3-2-4-9(7)6-11/h2-4H,1H3
SMILES string
Cc1c(cccc1C#N)C#N
InChI key
SVQCNROYIFLAMR-UHFFFAOYSA-N
assay
97%
bp
125-130 °C/2 mmHg (lit.)
mp
135-137 °C (lit.)
Application
2,6-Dicyanotoluene was used in the synthesis of E-2-(2,6-dcyanophenyl)-N,N-dimethylethenamine by undergoing condensation with dimethylformamide dimethyl acetal (DMFDMA).
signalword
Warning
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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C Y Watson et al.
Bioorganic & medicinal chemistry, 6(6), 721-734 (1998-07-29)
Inhibitors of poly(ADP-ribose)polymerase (PARP) inhibit repair of damaged DNA and thus potentiate radiotherapy and chemotherapy of cancer. 3-Substituted benzamides and 5-substituted isoquinolin-1-ones have been synthesised and evaluated for inhibition of PARP. Reduction of 3-(bromoacetyl)benzamide, followed by treatment with base, gave
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