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Home > Encyclopedia > 2-BROMO-4 6-DIMETHYLPHENYL ISOCYANATE

2-BROMO-4 6-DIMETHYLPHENYL ISOCYANATE

2-BROMO-4 6-DIMETHYLPHENYL ISOCYANATE structure

2-BROMO-4 6-DIMETHYLPHENYL ISOCYANATE 

structure
  • CAS No:

    78831-81-9

  • Formula:

    C9H8BrNO

  • Chemical Name:

    2-BROMO-4 6-DIMETHYLPHENYL ISOCYANATE

  • Synonyms:

    2-Bromo-4,6-dimethylphenyl isocyanate;1-bromo-2-isocyanato-3,5-dimethylbenzene;ACMC-20ao2l;SCHEMBL3012246;CTK5E6153;DTXSID40402761;ZINC2509907;Benzene,1-bromo-2-isocyanato-3,5-dimethyl-;1-bromanyl-2-isocyanato-3,5-dimethyl-benzene;2-BROMO-4 6-DIMETHYLPHENYL ISOCYANATE

2-BROMO-4 6-DIMETHYLPHENYL ISOCYANATE Basic Attributes

226.06992

224.97900

DTXSID40402761

2929109000

Characteristics

29.43000

3.03320

1.39g/cm3

261-262 °C(lit.)

>230 °F

n20/D 1.5750(lit.)

Safety Information

3

36/37/38

26-36

Xi

Computed Properties

Molecular Weight:226.07
XLogP3:4.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:224.97893
Monoisotopic Mass:224.97893
Topological Polar Surface Area:29.4
Heavy Atom Count:12
Complexity:201
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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