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1-methyl-3-methylsulfonyl-5-phenyl-1,2,4-triazole

1-methyl-3-methylsulfonyl-5-phenyl-1,2,4-triazole structure

CAS No:
154106-14-6
Formula:
C10H11N3O2S
Chemical Name:
1-methyl-3-methylsulfonyl-5-phenyl-1,2,4-triazole
Synonyms:
1H-1,2,4-Triazole,1-methyl-3-(methylsulfonyl)-5-phenyl; 1-Methyl-3-(methylsulfonyl)-5-phenyl-1H-1,2,4-triazole;

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1-methyl-3-methylsulfonyl-5-phenyl-1,2,4-triazole Basic Attributes

Molecular Weight：

237.27800

Exact Mass：

237.05719778

DSSTox ID：

DTXSID90165536

Characteristics

PSA：

73.23000

XLogP3：

1.96640

Density：

1.35g/cm3

Boiling Point：

457ºC

Flash Point：

226.4ºC

Refractive Index：

1.637

Vapor Pressure：

2.59E-08mmHg at 25°C

Computed Properties

Molecular Weight:237.28
XLogP3:1.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:237.05719778
Monoisotopic Mass:237.05719778
Topological Polar Surface Area:73.2
Heavy Atom Count:16
Complexity:333
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-methyl-3-methylsulfonyl-5-phenyl-1,2,4-triazole

Basic Attributes
Characteristics
Computed Properties

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