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4-AMINO-5-(3-CHLOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

4-AMINO-5-(3-CHLOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL structure

CAS No:
117320-66-8
Formula:
C8H7ClN4S
Chemical Name:
4-AMINO-5-(3-CHLOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
Synonyms:
4-amino-5-(3-chlorophenyl)-4H-1,2,4-triazole-3-thiol;4-amino-5-(3-chlorophenyl)-1,2,4-triazole-3-thiol;4-amino-3-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione;CHEMBL2287698;SCHEMBL13983994;CTK8E4755;CTK8F5699;DTXSID50395897;ZINC3886910;9927AC

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4-AMINO-5-(3-CHLOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL Basic Attributes

Molecular Weight：

226.69

Exact Mass：

226.00800

DSSTox ID：

DTXSID50395897

HScode：

2933990090

Characteristics

PSA：

95.53000

XLogP3：

2.18220

Density：

1.62g/cm3

Boiling Point：

348.9ºC at 760mmHg

Flash Point：

164.8ºC

Refractive Index：

1.775

Vapor Pressure：

4.89E-05mmHg at 25°C

Computed Properties

Molecular Weight:226.69
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:226.0079951
Monoisotopic Mass:226.0079951
Topological Polar Surface Area:85.7
Heavy Atom Count:14
Complexity:281
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-AMINO-5-(3-CHLOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

Basic Attributes
Characteristics
Computed Properties

4-AMINO-5-(3-CHLOROPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

SDS

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