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Home > Encyclopedia > 4-METHYLPHENACYLTHIOCYANATE

4-METHYLPHENACYLTHIOCYANATE

4-METHYLPHENACYLTHIOCYANATE structure

4-METHYLPHENACYLTHIOCYANATE 

structure
  • CAS No:

    6097-27-4

  • Formula:

    C10H9NOS

  • Chemical Name:

    4-METHYLPHENACYLTHIOCYANATE

  • Synonyms:

    4-METHYLPHENACYL THIOCYANATE;4-METHYLPHENACYL THIOCYANATE, 95+%;2-(4-METHYLPHENYL)-2-OXOETHYL THIOCYANATE;2-(cyanosulfanyl)-1-(4-Methylphenyl)ethan-1-one;4-(Thiocyanatoacetyl)toluene, 4-Methylphenacyl thiocyanate

4-METHYLPHENACYLTHIOCYANATE Basic Attributes

191.25000

191.04000

DTXSID60384499

2930909090

Characteristics

66.16000

2.39198

1.187g/cm3

105-107ºC

352.2ºC at 760 mmHg

166.8ºC

1.58

Safety Information

3

36/37

Xi

P264, P270, P301+P312, P330, P501

H302

Computed Properties

Molecular Weight:191.25
XLogP3:2.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:191.04048508
Monoisotopic Mass:191.04048508
Topological Polar Surface Area:66.2
Heavy Atom Count:13
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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