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4-ALLYL-5-(4-BROMOPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

4-ALLYL-5-(4-BROMOPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL structure

CAS No:
91813-57-9
Formula:
C11H10BrN3S
Chemical Name:
4-ALLYL-5-(4-BROMOPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
Synonyms:
Albb-003257;IVK/0010608;ZINC00276441;ZINC00120413;BAS 00914173;AJ-292/37229007;CHEMBRDG-BB 5731610;4-ALLYL-5-(4-BROMOPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL;4-allyl-5-(4-bromophenyl)-2H-1,2,4-triazole-3-thione;5-(4-bromophenyl)-4-prop-2-enyl-2H-1,2,4-triazole-3-thione

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4-ALLYL-5-(4-BROMOPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL Basic Attributes

Molecular Weight：

296.19

Exact Mass：

294.97800

DSSTox ID：

DTXSID70352124

HScode：

2933990090

Characteristics

PSA：

59.7

XLogP3：

3.18230

Density：

1.53g/cm3

Boiling Point：

345.3ºC at 760 mmHg

Flash Point：

162.6ºC

Refractive Index：

1.678

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:296.19
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:294.97788
Monoisotopic Mass:294.97788
Topological Polar Surface Area:59.7
Heavy Atom Count:16
Complexity:321
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-ALLYL-5-(4-BROMOPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-ALLYL-5-(4-BROMOPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

SDS

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