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4-(4-CHLORO-PHENYL)-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL

4-(4-CHLORO-PHENYL)-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL structure

CAS No:
74270-76-1
Formula:
C13H9ClN4S
Chemical Name:
4-(4-CHLORO-PHENYL)-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL
Synonyms:
4-(4-Chloro-phenyl)-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol;4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol;4-(4-Chlorophenyl)-5-(4-pyridinyl)-4h-1,2,4-triazole-3-thiol;4-(4-chlorophenyl)-5-(4-pyridyl)-1,2,4-triazole-3-thiol;SCHEMBL11919915;CTK8F5368;CTK9A3482;DTXSID00359565;ZINC5927174;SBB038359

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4-(4-CHLORO-PHENYL)-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL Basic Attributes

Molecular Weight：

288.753

Exact Mass：

288.02400

DSSTox ID：

DTXSID00359565

HScode：

2933990090

Characteristics

PSA：

72.6

XLogP3：

3.27140

Density：

1.44g/cm3

Boiling Point：

431.7ºC at 760 mmHg

Flash Point：

214.9ºC

Refractive Index：

1.733

Computed Properties

Molecular Weight:288.76
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:288.0236452
Monoisotopic Mass:288.0236452
Topological Polar Surface Area:72.6
Heavy Atom Count:19
Complexity:373
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(4-CHLORO-PHENYL)-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL

Basic Attributes
Characteristics
Computed Properties

4-(4-CHLORO-PHENYL)-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL

SDS

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