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4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL

4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL structure

CAS No:
668471-48-5
Formula:
C13H10Cl2N4S
Chemical Name:
4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL
Synonyms:
4-(2,4-dichlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4H-1,2,4-triazole-3-thiol;CTK8J9412;DTXSID10384464;ZINC141950;CCG-43766;MCULE-2535313257;DB-004467;FT-0711804;SR-01000633659-1;4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-[1,2,4]TRIAZOLE-3-THIOL

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4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL Basic Attributes

Molecular Weight：

325.22

Exact Mass：

324.00000

DSSTox ID：

DTXSID10384464

Characteristics

PSA：

64.6

XLogP3：

3.86830

Density：

1.52g/cm3

Melting Point：

252 °C

Boiling Point：

448.1ºC at 760 mmHg

Refractive Index：

1.727

Computed Properties

Molecular Weight:325.2
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:324.0003229
Monoisotopic Mass:324.0003229
Topological Polar Surface Area:64.6
Heavy Atom Count:20
Complexity:431
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL

Basic Attributes
Characteristics
Computed Properties

4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL

SDS

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