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Home > Encyclopedia > 4-ALLYL-5-(2-METHOXYPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL

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

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

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

structure
  • CAS No:

    23195-30-4

  • Formula:

    C12H13N3OS

  • Chemical Name:

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

  • Synonyms:

    4-allyl-5-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol;4-Allyl-5-(2-methoxy-phenyl)-4H-[1,2,4]triazole-3-thiol;MLS000665107;CHEMBL1411932;CTK5J4682;CTK8F5605;DTXSID80351264;HMS2567N10;ZINC503887;ALBB-003272

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

247.32

247.07800

DTXSID80351264

2933990090

Characteristics

69

2.42840

1.22g/cm3

349.6ºC at 760 mmHg

165.2ºC

1.62

Safety Information

IRRITANT

Computed Properties

Molecular Weight:247.32
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:247.07793322
Monoisotopic Mass:247.07793322
Topological Polar Surface Area:69
Heavy Atom Count:17
Complexity:343
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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