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Substance Name: Carbamic acid, N-(5-isocyanato-2(or 4)-methylphenyl)-, C,C'-(1-methyl-1,3-propanediyl) ester
RN: 68366-14-3
InChIKey: MBABXWXSNOGEQB-UHFFFAOYSA-N

Molecular Formula

  • C22-H22-N4-O6

Molecular Weight

  • 438.438
 
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Names and Synonyms

Synonyms

  • 1,3-Butanediol, toluene 2,4-diisocyanate urethane (1:2)
  • 1-Methyl-1,3-propanediyl(5-isocyanato-2(or 4)-methylphenyl)carbamate
  • EINECS 269-859-9

Systematic Names

  • 1-Methylpropane-1,3-diyl bis((3-isocyanatomethylphenyl)carbamate)
  • Carbamic acid, (5-isocyanato-2(or 4)-methylphenyl)-, 1-methyl-1,3-propanediyl ester
  • Carbamic acid, N-(5-isocyanato-2(or 4)-methylphenyl)-, C,C'-(1-methyl-1,3-propanediyl) ester

Registry Numbers

CAS Registry Number

  • 68366-14-3

System Generated Number

  • 0068366143

Structure Descriptors

InChI

1S/C22H22N4O6/c1-16(32-22(30)26-20-7-3-5-18(11-20)13-24-15-28)8-9-31-21(29)25-19-6-2-4-17(10-19)12-23-14-27/h2-7,10-11,16H,8-9,12-13H2,1H3,(H,25,29)(H,26,30)

InChIKey

MBABXWXSNOGEQB-UHFFFAOYSA-N

Smiles

O=C=NCc1cc(NC(=O)O[C@@H](C)CCOC(=O)Nc2cc(CN=C=O)ccc2)ccc1