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1,2,5,6,7,8,9,10-Octahydro-2-thioxocycloocta[b]pyridine-3-carbonitrile

1,2,5,6,7,8,9,10-Octahydro-2-thioxocycloocta[b]pyridine-3-carbonitrile structure

CAS No:
154384-02-8
Formula:
C12H14N2S
Chemical Name:
1,2,5,6,7,8,9,10-Octahydro-2-thioxocycloocta[b]pyridine-3-carbonitrile
Synonyms:
Cycloocta[b]pyridine-3-carbonitrile,1,2,5,6,7,8,9,10-octahydro-2-thioxo-;1,2,5,6,7,8,9,10-Octahydro-2-thioxocycloocta[b]pyridine-3-carbonitrile;2-Sulfanylidene-5,6,7,8,9,10-hexahydro-1H-cycloocta[b]pyridine-3-carbonitrile;2-Sulfanyl-5H,6H,7H,8H,9H,10H-cycloocta[b]pyridine-3-carbonitrile;2-Thioxo-5,6,7,8,9,10-hexahydro-1H-cycloocta[b]pyridine-3-carbonitrile

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1,2,5,6,7,8,9,10-Octahydro-2-thioxocycloocta[b]pyridine-3-carbonitrile Basic Attributes

Molecular Weight：

218.32 g/mol

Exact Mass：

218.32

Characteristics

PSA：

67.9 Å²

XLogP3：

3.27488

Melting Point：

258 - 260 °C

Computed Properties

Molecular Weight:218.32
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:218.08776963
Monoisotopic Mass:218.08776963
Topological Polar Surface Area:67.9
Heavy Atom Count:15
Complexity:395
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2,5,6,7,8,9,10-Octahydro-2-thioxocycloocta[b]pyridine-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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