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2-(2,4-Difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)-1,2-propanediol

2-(2,4-Difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)-1,2-propanediol structure

CAS No:
118689-07-9
Formula:
C11H11F2N3O2
Chemical Name:
2-(2,4-Difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)-1,2-propanediol
Synonyms:
D-3-Desoxy-3-fluor-myo-inosit; D-3-deoxy-3-fluoro-myo-inositol; 2,6-DIMETHOXY-4-HYDROXYBENZALDEHYDE; 3-Deoxy-3-fluoroinositol; 1D-3-deoxy-3-fluoro-myo-inositol; 3-deoxy-3-fluoro-D-myo-inositol; D-myo-Inositol,3-deoxy-3-fluoro; 3-Deoxy-3-fluoro-myo-inositol;Expand

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2-(2,4-Difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)-1,2-propanediol Basic Attributes

Molecular Weight：

255.22100

Exact Mass：

255.08193293

Characteristics

PSA：

71.17000

XLogP3：

0.43640

Density：

1.42

Boiling Point：

490.042ºC at 760 mmHg

Flash Point：

250.168ºC

Refractive Index：

1.589

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:255.22
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:255.08193293
Monoisotopic Mass:255.08193293
Topological Polar Surface Area:71.2
Heavy Atom Count:18
Complexity:285
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(2,4-Difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)-1,2-propanediol

Basic Attributes
Characteristics
Computed Properties

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