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Substance Name: Acetonitrile, 2,2',2''-nitrilotris-
RN: 7327-60-8
UNII: 86K27312YB
InChIKey: LJAIDEYQVIJERM-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C6-H6-N4

Molecular Weight

  • 134.141
 
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Names and Synonyms

Name of Substance

  • Acetonitrile, 2,2',2''-nitrilotris-

Synonyms

  • 2,2',2''-Nitrilotrisacetonitrile
  • Acetonitrile, nitrilotri-
  • EC 230-804-9
  • EINECS 230-804-9
  • Nitrilotriacetonitrile
  • Nitrilotrisacetonitrile
  • NSC 93814
  • UNII-86K27312YB

Systematic Names

  • Acetonitrile, 2,2',2''-nitrilotris-
  • Acetonitrile, nitrilotri- (8CI)
  • Nitrilotriacetonitrile

Superlist Name

  • Acetonitrile, nitrilotri-

Registry Numbers

CAS Registry Number

  • 7327-60-8

FDA UNII

  • 86K27312YB

System Generated Number

  • 0007327608

Structure Descriptors

InChI

1S/C6H6N4/c7-1-4-10(5-2-8)6-3-9/h4-6H2

InChIKey

LJAIDEYQVIJERM-UHFFFAOYSA-N

Smiles

N#CCN(CC#N)CC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 skin > 1gm/kg (1000mg/kg)   National Technical Information Service. Vol. OTS0571887,
mouse LD50 intraperitoneal 10mg/kg (10mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
National Technical Information Service. Vol. OTS0571887,
mouse LD50 oral 50mg/kg (50mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
National Technical Information Service. Vol. OTS0571887,
rabbit LD50 skin > 2gm/kg (2000mg/kg)   National Technical Information Service. Vol. OTS0570625,
rat LD50 intraperitoneal 50mg/kg (50mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
National Technical Information Service. Vol. OTS0571887,
rat LD50 oral 50mg/kg (50mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
National Technical Information Service. Vol. OTS0571887,