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2-(1-methyltriazol-4-yl)-6-nitrochromen-4-one

2-(1-methyltriazol-4-yl)-6-nitrochromen-4-one structure

CAS No:
131924-53-3
Formula:
C12H8N4O4
Chemical Name:
2-(1-methyltriazol-4-yl)-6-nitrochromen-4-one
Synonyms:
2-(1-Methyl-1H-1,2,3-triazol-4-yl)-6-nitro-4H-1-benzopyran-4-one; 4H-1-Benzopyran-4-one,2-(1-methyl-1H-1,2,3-triazol-4-yl)-6-nitro;

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2-(1-methyltriazol-4-yl)-6-nitrochromen-4-one Basic Attributes

Molecular Weight：

272.21600

Exact Mass：

272.05455475

DSSTox ID：

DTXSID60157266

Characteristics

PSA：

106.74000

XLogP3：

2.01990

Density：

1.61g/cm3

Boiling Point：

516.4ºC

Flash Point：

266.1ºC

Refractive Index：

1.738

Vapor Pressure：

9.03E-11mmHg at 25°C

Computed Properties

Molecular Weight:272.22
XLogP3:0.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:272.05455475
Monoisotopic Mass:272.05455475
Topological Polar Surface Area:103
Heavy Atom Count:20
Complexity:461
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1-methyltriazol-4-yl)-6-nitrochromen-4-one

Basic Attributes
Characteristics
Computed Properties

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