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2-chloro-1-isocyanato-4-methylbenzene
Weight167.595 g/mol
FormulaC8H6ClNO
Hydrogen Acceptors2
Hydrogen Donors0
Aromatic Rings1
Rotatable Bonds1

2-chloro-1-isocyanato-4-methylbenzene (40398-00-3)

40398-00-3

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Alternate Names

  • 40398-00-3
  • SMILES
    CC1=CC(=C(C=C1)N=C=O)Cl
  • InChIKey
    QVCZOTVTRWNPAF-UHFFFAOYSA-N

Estimated Properties

Boiling Point 220.28 C EPA T.E.S.T.
Boiling Point 211.45 C EPI Suite
Density 1.19 g/cm3 EPA T.E.S.T.
Flash Point 96.53 C EPA T.E.S.T.
Melting Point 11.45 C EPI Suite
Water Solubility 108.88 mg/L EPI Suite

External Links

Similar Compounds

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