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Home > Encyclopedia > S-(4-methylphenyl) 2,2,2-trifluoroethanethioate

S-(4-methylphenyl) 2,2,2-trifluoroethanethioate

S-(4-methylphenyl) 2,2,2-trifluoroethanethioate structure

S-(4-methylphenyl) 2,2,2-trifluoroethanethioate 

structure
  • CAS No:

    75072-07-0

  • Formula:

    C9H7F3OS

  • Chemical Name:

    S-(4-methylphenyl) 2,2,2-trifluoroethanethioate

  • Synonyms:

    PC3388; p-tolyl thiotrifluoroacetate;

S-(4-methylphenyl) 2,2,2-trifluoroethanethioate Basic Attributes

220.21100

220.01697050

DTXSID30382083

2930909090

Characteristics

42.37000

3.17600

1.32g/cm3

213.1ºC at 760 mmHg

82.7ºC

1.503

Safety Information

Xi

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

Computed Properties

Molecular Weight:220.21
XLogP3:3.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:220.01697050
Monoisotopic Mass:220.01697050
Topological Polar Surface Area:42.4
Heavy Atom Count:14
Complexity:207
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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