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Home > Encyclopedia > 3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazole

3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazole

3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazole structure

3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazole 

structure
  • CAS No:

    677735-77-2

  • Formula:

    C26H26ClN3S

  • Chemical Name:

    3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazole

  • Synonyms:

    3-((4-(tert-Butyl)benzyl)thio)-5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazole;677735-77-2;ZINC2262842;SALOR-INT L406503-1EA;STK554607;AKOS001050251;MCULE-6158572182;ST50085499;3-((4-TERT-BUTYLBENZYL)THIO)-5-(4-CL-PH)-4-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOLE;3-[(4-tert-butylbenzyl)sulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole;3-{[4-(tert-butyl)phenyl]methylthio}-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2 ,4-triazole

3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazole Basic Attributes

448.0 g/mol

447.1535967 g/mol

Characteristics

56 Ų

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:448.0
XLogP3:7.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:447.1535967
Monoisotopic Mass:447.1535967
Topological Polar Surface Area:56
Heavy Atom Count:31
Complexity:543
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazole

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