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5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione structure

CAS No:
126651-85-2
Formula:
C8H6BrN3S
Chemical Name:
5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Synonyms:
5-(3-Bromo-phenyl)-2,4-dihydro-[1,2,4]triazole-3-thione;5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione;5-(3-bromophenyl)-4H-1,2,4-triazole-3-thiol;5-(3-bromophenyl)-1,2-dihydro-1,2,4-triazole-3-thione;MLS-0036354.0001;3-(3-bromophenyl)-1,2,4-triazoline-5-thione;3-(3-Bromophenyl)-1H-1,2,4-triazole-5(4H)-thione;TimTec1_003964;MLS000106438;cid_676286

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5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

256.13

Exact Mass：

254.94700

DSSTox ID：

DTXSID70350261

HScode：

2933990090

Characteristics

PSA：

68.5

XLogP3：

2.89680

Density：

1.83g/cm3

Boiling Point：

326.6ºC at 760 mmHg

Flash Point：

151.3ºC

Refractive Index：

1.775

Vapor Pressure：

0.000214mmHg at 25°C

Computed Properties

Molecular Weight:256.12
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:254.94658
Monoisotopic Mass:254.94658
Topological Polar Surface Area:68.5
Heavy Atom Count:13
Complexity:254
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Computed Properties

5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

SDS

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