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Home > Encyclopedia > ALPHA,ALPHA'-DITHIOCYANATO-P-XYLENE

ALPHA,ALPHA'-DITHIOCYANATO-P-XYLENE

ALPHA,ALPHA'-DITHIOCYANATO-P-XYLENE structure

ALPHA,ALPHA'-DITHIOCYANATO-P-XYLENE 

structure
  • CAS No:

    1014-99-9

  • Formula:

    C10H8N2S2

  • Chemical Name:

    ALPHA,ALPHA'-DITHIOCYANATO-P-XYLENE

  • Synonyms:

    p-Xylylene Dithiocyanate;1,4-bis(thiocyanatomethyl)benzene;p-XTC;p-Xylylenedithiocyanate;ACMC-2097vk;[4-(thiocyanatomethyl)phenyl]methyl thiocyanate;SCHEMBL4941438;CTK8A8995;DTXSID40403516;alpha,alpha"-Dithiocyanato-p-xylene

ALPHA,ALPHA'-DITHIOCYANATO-P-XYLENE Basic Attributes

220.31

220.01300

DTXSID40403516

2930909090

Characteristics

98.2

3.11516

1.14±0.1 g/cm3(Predicted)

137 °C

372.9±22.0 °C(Predicted)

193.8ºC

1.64

1.65E-06mmHg at 25°C

Safety Information

III

6.1

2811

P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H301

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, 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:220.3
XLogP3:2.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:220.01289061
Monoisotopic Mass:220.01289061
Topological Polar Surface Area:98.2
Heavy Atom Count:14
Complexity:224
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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