13893-53-3

Name 2-Amino-2,3-dimethylbutyronitrile
CAS 13893-53-3
EINECS(EC#) 219-735-5
Molecular Formula C6H12N2
MDL Number MFCD00661864
Molecular Weight 112.17
MOL File 13893-53-3.mol
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Chemical Properties

Boiling point  43 °C
density  0.896±0.06 g/cm3(Predicted)
vapor pressure  8.98-101430Pa at 20-165.5℃
storage temp.  under inert gas (nitrogen or Argon) at 2–8 °C
solubility  Chloroform, Methanol (Slightly)
form  Oil
pka 5.18±0.25(Predicted)
color  Light Yellow
InChI InChI=1S/C6H12N2/c1-5(2)6(3,8)4-7/h5H,8H2,1-3H3
InChIKey CAOHBROWLMCZRP-UHFFFAOYSA-N
SMILES C(#N)C(N)(C)C(C)C
LogP 0.7 at 23℃ and pH6.1-10.5
Dissociation constant 5 at 25℃
CAS DataBase Reference 13893-53-3(CAS DataBase Reference)
EPA Substance Registry System 13893-53-3(EPA Substance)

Safety Data

TSCA  TSCA listed
REACH Registrations Active
HS Code  2926907090
Toxicity
rat,LD50,skin,95mg/kg (95mg/kg),BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)LUNGS, THORAX, OR RESPIRATION: DYSPNEABEHAVIORAL: ATAXIA,National Technical Information Service. Vol. OTS0540156,

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