ChemicalBook--->CAS DataBase List--->111-94-4

111-94-4

111-94-4 Structure

111-94-4 Structure
IdentificationMore
[Name]

3,3'-IMINODIPROPIONITRILE
[CAS]

111-94-4
[Synonyms]

3,3'-IMINODIPROPIONITRILE
3,3'-IMINODIPROPIONONITRILE
BIS(2-CYANOETHYL)AMINE
BIS(CYANOETHYL)AMINE
Bis(β-cyanoethyl)amine 3,3′-Iminodipropionitrile
LABOTEST-BB LTBB000489
TIMTEC-BB SBB007920
.beta.,.beta.’-Iminodipropionitrile
2,2’-dicyano-diethylamin
2341 I.S.
2341i.s.
2-cyano-n-(2-cyanoethyl)-ethanamin
3,3’-azanediyl-bis-propionitrile
3,3’-iminobis(propanenitrile)
3,3’-iminobis-propanenitril
3,3’-iminobis-Propanenitrile
3,3’-Imino-di-propionitril
3,3’-iminodi-propionitril
3,3'-Iminobis(propionitrile
3,3'-Iminobis[propanenitrile]
[EINECS(EC#)]

203-922-3
[Molecular Formula]

C6H9N3
[MDL Number]

MFCD00001956
[Molecular Weight]

123.16
[MOL File]

111-94-4.mol
Chemical PropertiesBack Directory
[Appearance]

colourless liquid
[Melting point ]

-6 °C
[Boiling point ]

205 °C25 mm Hg(lit.)
[density ]

1.02 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.47(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[pka]

6.13±0.19(Predicted)
[Stability:]

Stable, but moisture sensitive. Reaction with moisture may lead to a build up of pressure in sealed bottles. Combustible. Incompatible with strong oxidizing agents.
[Water Solubility ]

Soluble in water.
[CAS DataBase Reference]

111-94-4(CAS DataBase Reference)
[EPA Substance Registry System]

3,3'-Iminobispropanenitrile (111-94-4)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[RIDADR ]

UN 3334
[WGK Germany ]

2
[RTECS ]

UG2975000
[TSCA ]

Yes
[HS Code ]

29269095
[Hazardous Substances Data]

111-94-4(Hazardous Substances Data)
[Toxicity]

A neurotoxic synthetic nitrile that causes proximal axonopathies in the spinal cord and brain stem. The proximal axonal swellings are due to interruption of slow axonal transport, resulting in a large accumulation of neurofilaments. Secondary to these effects is a progressive atrophy of the distal axon, secondary demyelination, and gliosis. The slow axonal transport defect appears to be selective, as little evidence for perturbations in fast axonal transport have been reported. Behaviorally, IDPN induces hyperactivity, a “waltzing syndrome,” circling and head-rolling in mice and rats. IDPN intoxication has been advanced as a model for certain motor neuron degenerative diseases such as amyotropic lateral sclerosis (ALS) and hereditary canine spinal muscular atrophy (HCSMA).
Hazard InformationBack Directory
[General Description]

Clear colorless liquid.
[Reactivity Profile]

Nitriles, such as 3,3'-IMINODIPROPIONITRILE(111-94-4), may polymerize in the presence of metals and some metal compounds. They are incompatible with acids; mixing nitriles with strong oxidizing acids can lead to extremely violent reactions. Nitriles are generally incompatible with other oxidizing agents such as peroxides and epoxides. The combination of bases and nitriles can produce hydrogen cyanide. Nitriles are hydrolyzed in both aqueous acid and base to give carboxylic acids (or salts of carboxylic acids). These reactions generate heat. Peroxides convert nitriles to amides. Nitriles can react vigorously with reducing agents. Acetonitrile and propionitrile are soluble in water, but nitriles higher than propionitrile have low aqueous solubility. They are also insoluble in aqueous acids.
[Air & Water Reactions]

Water soluble. Moisture sensitive. Some 18-month old bottles of this compound exploded, probably owing to slow hydrolysis and buildup of pressure. Solutions in water are unstable above pH 4. .
[Fire Hazard]

This chemical is combustible.
[Chemical Properties]

colourless liquid
[Uses]

Bis(2-cyanoethyl)amine is used as pharmaceutical intermediates.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

bis(beta-cyanoethyl)amine(111-94-4).msds
Spectrum DetailBack Directory
[Spectrum Detail]

3,3'-IMINODIPROPIONITRILE(111-94-4)MS
3,3'-IMINODIPROPIONITRILE(111-94-4)1HNMR
3,3'-IMINODIPROPIONITRILE(111-94-4)13CNMR
3,3'-IMINODIPROPIONITRILE(111-94-4)IR1
3,3'-IMINODIPROPIONITRILE(111-94-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,3'-Iminodipropionitrile, 99+%(111-94-4)
[Alfa Aesar]

Bis(2-cyanoethyl)amine, tech. 90%(111-94-4)
[Sigma Aldrich]

111-94-4(sigmaaldrich)
[TCI AMERICA]

3,3'-Iminodipropionitrile,>98.0%(GC)(111-94-4)
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