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2-(4-Bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-2,4-dihydro-5-methyl-3H-1,2,4-triazol-3-one

2-(4-Bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-2,4-dihydro-5-methyl-3H-1,2,4-triazol-3-one structure

CAS No:
111992-11-1
Formula:
C10H6BrF3N4O3
Chemical Name:
2-(4-Bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-2,4-dihydro-5-methyl-3H-1,2,4-triazol-3-one
Synonyms:
2-(4-BROMO-2-FLUORO-5-NITROPHENYL)-4-(DIFLUOROMETHYL)-2,4-DIHYDRO-5-METHYL-3H-1,2,4-TRIAZOL-3-ONE;SCHEMBL7888987;DTXSID90562349;ZINC34331738;992B111;2-(4-bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-5-methyl-1,2,4-triazol-3-one;2-(4-Bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one

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2-(4-Bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-2,4-dihydro-5-methyl-3H-1,2,4-triazol-3-one Basic Attributes

Molecular Weight：

367.08

Exact Mass：

365.95800

DSSTox ID：

DTXSID90562349

Characteristics

PSA：

81.7

XLogP3：

3.07050

Density：

1.97

Boiling Point：

370.9ºC at 760 mmHg

Computed Properties

Molecular Weight:367.08
XLogP3:2.7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:365.95754
Monoisotopic Mass:365.95754
Topological Polar Surface Area:81.7
Heavy Atom Count:21
Complexity:487
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-Bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-2,4-dihydro-5-methyl-3H-1,2,4-triazol-3-one

Basic Attributes
Characteristics
Computed Properties

2-(4-Bromo-2-fluoro-5-nitrophenyl)-4-(difluoromethyl)-2,4-dihydro-5-methyl-3H-1,2,4-triazol-3-one

SDS

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