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Home > Encyclopedia > 4-ISOCYANATO-1,3,5-TRIMETHYL-1H-PYRAZOLE

4-ISOCYANATO-1,3,5-TRIMETHYL-1H-PYRAZOLE

4-ISOCYANATO-1,3,5-TRIMETHYL-1H-PYRAZOLE structure

4-ISOCYANATO-1,3,5-TRIMETHYL-1H-PYRAZOLE 

structure
  • CAS No:

    252956-48-2

  • Formula:

    C7H9N3O

  • Chemical Name:

    4-ISOCYANATO-1,3,5-TRIMETHYL-1H-PYRAZOLE

  • Synonyms:

    1,3,5-Trimethyl-1H-pyrazol-4-yl isocyanate 97%;4-ISOCYANATO-1,3,5-TRIMETHYL-1H-PYRAZOLE;4-Isocyanato-1,3-5-trimethyl-1H-pyrazole 97%;1,3,5-Trimethyl-1H-pyrazol-4-yl isocyanate;1H-Pyrazole, 4-isocyanato-1,3,5-trimethyl-

4-ISOCYANATO-1,3,5-TRIMETHYL-1H-PYRAZOLE Basic Attributes

151.17

151.074561919

DTXSID80428167

2933199090

Characteristics

47.25000

1.00420

1.14±0.1 g/cm3

36 °C

76-80/2mm

95.3ºC

1.561

0.0541mmHg at 25°C

1.73±0.10

Safety Information

25

45

Xi,T

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, 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:151.17
XLogP3:1.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:151.074561919
Monoisotopic Mass:151.074561919
Topological Polar Surface Area:47.2
Heavy Atom Count:11
Complexity:188
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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