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1,2-Dihydro-4,6-diphenyl-2-thioxo-3-pyridinecarbonitrile

1,2-Dihydro-4,6-diphenyl-2-thioxo-3-pyridinecarbonitrile structure

CAS No:
58327-74-5
Formula:
C18H12N2S
Chemical Name:
1,2-Dihydro-4,6-diphenyl-2-thioxo-3-pyridinecarbonitrile
Synonyms:
3-Pyridinecarbonitrile,1,2-dihydro-4,6-diphenyl-2-thioxo-;1,2-Dihydro-4,6-diphenyl-2-thioxo-3-pyridinecarbonitrile;4,6-Diphenyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile;2-Mercapto-4,6-diphenylnicotinonitrile

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1,2-Dihydro-4,6-diphenyl-2-thioxo-3-pyridinecarbonitrile Basic Attributes

Molecular Weight：

288.36600

Exact Mass：

288.37

DSSTox ID：

DTXSID20207059

Characteristics

PSA：

75.48000

XLogP3：

4.57598

Density：

1.29g/cm3

Melting Point：

228-230 °C @ Solvent: Acetic acid

Boiling Point：

449ºC

Flash Point：

225.3ºC

Refractive Index：

1.711

Computed Properties

Molecular Weight:288.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:288.07211956
Monoisotopic Mass:288.07211956
Topological Polar Surface Area:67.9
Heavy Atom Count:21
Complexity:523
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2-Dihydro-4,6-diphenyl-2-thioxo-3-pyridinecarbonitrile

Basic Attributes
Characteristics
Computed Properties

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