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Home > Encyclopedia > 3,5-DIMETHYLISOXAZOL-4-YL ISOCYANATE

3,5-DIMETHYLISOXAZOL-4-YL ISOCYANATE

3,5-DIMETHYLISOXAZOL-4-YL ISOCYANATE structure

3,5-DIMETHYLISOXAZOL-4-YL ISOCYANATE 

structure
  • CAS No:

    131825-41-7

  • Formula:

    C6H6N2O2

  • Chemical Name:

    3,5-DIMETHYLISOXAZOL-4-YL ISOCYANATE

  • Synonyms:

    BUTTPARK 154\15-63;3,5-DIMETHYLISOXAZOL-4-YL ISOCYANATE;3,5-DIMETHYLISOXAZOLE-4-ISOCYANATE;Isoxazole, 4-isocyanato-3,5-dimethyl- (9CI);3,5-Dimethylisoxazole-4-isocyanate 97%;4-Isocyanoto-3,5-dimethyl-isoxazole;3,5-Dimethylisoxazol-4-yl isocyanate ,95%;3,5-Dimethyl-4-isocyanatoisoxazole

  • Categories:

    Chemical Reagents  >  Organic Reagents

3,5-DIMETHYLISOXAZOL-4-YL ISOCYANATE Basic Attributes

138.12

138.04300

DTXSID60371243

2934999090

Characteristics

55.5

1.25870

1.23g/cm3

96-98°C15mm

90.2ºC

1.549

Safety Information

2206

20/21/22-36/37/38

26-36/37/39

Xi

Irritant

|Danger|H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:138.12
XLogP3:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:138.042927438
Monoisotopic Mass:138.042927438
Topological Polar Surface Area:55.5
Heavy Atom Count:10
Complexity:165
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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