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Home > Encyclopedia > 5-isocyanato-2-methylaniline

5-isocyanato-2-methylaniline

5-isocyanato-2-methylaniline structure

5-isocyanato-2-methylaniline 

structure
  • CAS No:

    99626-88-7

  • Formula:

    C8H8N2O

  • Chemical Name:

    5-isocyanato-2-methylaniline

  • Synonyms:

    4-TIA;toluene-4-isocyanate-2-amine;Toluene-4-isocyanate-2-amine;99626-88-7;4-TIA;5-isocyanato-2-methylaniline;5-Isocyanato-2-methylbenzenamine;SCHEMBL13479105;DTXSID30244172;Benzenamine, 5-isocyanato-2-methyl-;AKOS006347992

5-isocyanato-2-methylaniline Basic Attributes

148.16 g/mol

148.063662883 g/mol

DTXSID30244172

Characteristics

55.4 Ų

Drug Information

4-TIA

Computed Properties

Molecular Weight:148.16
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:148.063662883
Monoisotopic Mass:148.063662883
Topological Polar Surface Area:55.4
Heavy Atom Count:11
Complexity:175
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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