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Substance Name: Isocyanic acid, p-xylylene ester
RN: 1014-98-8
InChIKey: OHLKMGYGBHFODF-UHFFFAOYSA-N

Molecular Formula

  • C10-H6-N2-O2

Molecular Weight

  • 188.1852
 
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Names and Synonyms

Synonym

  • p-Xylylene isocyanate

Systematic Name

  • Isocyanic acid, p-xylylene ester

Registry Numbers

CAS Registry Number

  • 1014-98-8

System Generated Number

  • 0001014988

Structure Descriptors

InChI

1S/C10H8N2O2/c13-7-11-5-9-1-2-10(4-3-9)6-12-8-14/h1-4H,5-6H2

InChIKey

OHLKMGYGBHFODF-UHFFFAOYSA-N

Smiles

c1cc(ccc1CN=C=O)CN=C=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 900mg/kg (900mg/kg)   Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. Vol. 15, Pg. 128, 1979.
rat LD50 oral 4500mg/kg (4500mg/kg)   Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. Vol. 15, Pg. 128, 1979.