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Home > Encyclopedia > 4,5-Diphenyl-2(3H)-oxazolethione

4,5-Diphenyl-2(3H)-oxazolethione

4,5-Diphenyl-2(3H)-oxazolethione structure

4,5-Diphenyl-2(3H)-oxazolethione 

structure
  • CAS No:

    6670-13-9

  • Formula:

    C15H11NOS

  • Chemical Name:

    4,5-Diphenyl-2(3H)-oxazolethione

  • Synonyms:

    2(3H)-Oxazolethione,4,5-diphenyl-;4-Oxazoline-2-thione,4,5-diphenyl-;4,5-Diphenyl-2(3H)-oxazolethione;4,5-Diphenyl-Δ4-oxazoline-2-thione;4,5-Diphenyl-4-oxazoline-2-thione;4,5-Diphenyl-2-mercaptooxazole;4,5-Diphenyl-1,3-isoxazole-2-thiol;2-Mercapto-4,5-diphenyloxazole;10090-94-5

Description

light yellow crystalline powder

4,5-Diphenyl-2(3H)-oxazolethione Basic Attributes

253.32

253.32

229-707-4

DTXSID90216850

2934999090

Characteristics

53.4

3.6

1.31g/cm3

260 °C

390.6°C at 760 mmHg

190.1ºC

1.708

Safety Information

3

20/21/22

S36

Xn

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

H302

|Warning|H302 (91.11%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 45 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:253.32
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:253.05613515
Monoisotopic Mass:253.05613515
Topological Polar Surface Area:53.4
Heavy Atom Count:18
Complexity:352
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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