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6-(Phenylsulfonyl)-1,2,4-triazine-3,5(2H,4H)-dione

6-(Phenylsulfonyl)-1,2,4-triazine-3,5(2H,4H)-dione structure

CAS No:
90323-31-2
Formula:
C9H7N3O4S
Chemical Name:
6-(Phenylsulfonyl)-1,2,4-triazine-3,5(2H,4H)-dione
Synonyms:
1,2,4-Triazine-3,5(2H,4H)-dione,6-(phenylsulfonyl)-;as-Triazine-3,5-diol,6-(phenylsulfonyl)-;6-(Phenylsulfonyl)-1,2,4-triazine-3,5(2H,4H)-dione;NSC 107695

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6-(Phenylsulfonyl)-1,2,4-triazine-3,5(2H,4H)-dione Basic Attributes

Molecular Weight：

253.24 g/mol

Exact Mass：

253.23

NSC Number：

107695

DSSTox ID：

DTXSID40296107

Characteristics

PSA：

113 Å²

Computed Properties

Molecular Weight:253.24
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:253.01572689
Monoisotopic Mass:253.01572689
Topological Polar Surface Area:113
Heavy Atom Count:17
Complexity:471
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(Phenylsulfonyl)-1,2,4-triazine-3,5(2H,4H)-dione

Basic Attributes
Characteristics
Computed Properties

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