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1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole

1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole structure

CAS No:
147917-48-4
Formula:
C12H16N4O2
Chemical Name:
1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole
Synonyms:
1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole;1-(1-adamantyl)-3-nitro-1,2,4-triazole;Cambridge id 5323517;Oprea1_822195;MLS001047259;CHEMBL1531484;HMS2801P12;ZINC4576808;STK301998;AKOS003790854

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1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole Basic Attributes

Molecular Weight：

248.28104

Exact Mass：

248.127

Characteristics

PSA：

76.5

XLogP3：

1.9

Water Solubility：

30.2 [ug/mL]

Computed Properties

Molecular Weight:248.28
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:248.12732577
Monoisotopic Mass:248.12732577
Topological Polar Surface Area:76.5
Heavy Atom Count:18
Complexity:340
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(1-adamantyl)-3-nitro-1H-1,2,4-triazole

Basic Attributes
Characteristics
Computed Properties

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