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

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

CAS No:
93300-54-0
Formula:
C14H10ClN3S
Chemical Name:
5-(4-CHLORO-PHENYL)-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL
Synonyms:
5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazole-3-thiol;5-(4-Chloro-phenyl)-4-phenyl-4H-[1,2,4]triazole-3-thiol;5-(4-chlorophenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione;C14H10ClN3S;5-(4-chlorophenyl)-4-phenyl-1,2,4-triazole-3-thiol;5-(4-Chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl hydrosulfide;5-(4-CHLORO-PHENYL)-4-PHENYL-4H-(1,2,4)TRIAZOLE-3-THIOL;SCHEMBL1104429;DTXSID90353052;ZINC239013

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

Molecular Weight：

287.76700

Exact Mass：

287.02800

DSSTox ID：

DTXSID90353052

HScode：

2933990090

Characteristics

PSA：

69.51000

XLogP3：

3.87640

Density：

1.36g/cm3

Boiling Point：

392.1ºC at 760mmHg

Flash Point：

190.9ºC

Refractive Index：

1.699

Computed Properties

Molecular Weight:287.8
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:287.0283962
Monoisotopic Mass:287.0283962
Topological Polar Surface Area:59.7
Heavy Atom Count:19
Complexity:371
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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

SDS

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