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Substance Name: 2,4-Hexadienenitrile
RN: 1516-01-4
InChIKey: NYKHMTWWXWMMHN-MQQKCMAXSA-N

Molecular Formula

  • C6-H7-N

Molecular Weight

  • 93.1283
 
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Names and Synonyms

Synonyms

  • 2,4-Hexadiene-1-nitrile
  • Sorbonitrile

Systematic Name

  • 2,4-Hexadienenitrile

Registry Numbers

CAS Registry Number

  • 1516-01-4

System Generated Number

  • 0001516014

Structure Descriptors

InChI

1S/C6H7N/c1-2-3-4-5-6-7/h2-5H,1H3/b3-2+,5-4+

InChIKey

NYKHMTWWXWMMHN-MQQKCMAXSA-N

Smiles

N#C\C=C\C=C\C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LDLo skin 10mL/kg (10mL/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, OTHER: AFTER SYSTEMIC EXPOSURE" National Technical Information Service. Vol. OTS0555052,
rat LD50 oral 712mg/kg (712mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
National Technical Information Service. Vol. OTS0555052,