3-(BENZYLAMINO)PROPIONITRILE

CAS NO.：706-03-6
Empirical Formula: C10H12N2
Molecular Weight: 160.22
MDL number: MFCD00001955
EINECS: 211-890-7
SAFETY DATA SHEET (SDS)
Update Date: 2023-04-23 13:52:06

What is 3-(BENZYLAMINO)PROPIONITRILE?

Chemical properties

CLEAR COLOURLESS LIQUID

The Uses of 3-(BENZYLAMINO)PROPIONITRILE

3-(BenzylaMino)propionitrile is used in the michael addition of primary and secondary amines to acrylonitrile catalyzed by lipases.

The Uses of 3-(BENZYLAMINO)PROPIONITRILE

3-(Benzylamino)propionitrile was used as starting reagent in the synthesis of:

(3R,4S)-1-benzyl-4-phenylpyrrolidine-3-carboxylic acid, key chiral building block for synthesis of biologically active compounds
1-{[benzyl-(2-cyano-ethyl)-amino]-methyl}-5-methyl-1H-pyrazole-3-carboxylic acid ethyl ester
3-[benzyl-(3,5-dimethyl-pyrazol-1-ylmethyl)-amino]-propionitrile

What are the applications of Application

3-(Benzylamino)propionitrile was used as starting reagent in the synthesis of:
(3R,4S)-1-benzyl-4-phenylpyrrolidine-3-carboxylic acid, key chiral building block for synthesis of biologically active compounds
1-{[benzyl-(2-cyano-ethyl)-amino]-methyl}-5-methyl-1H-pyrazole-3-carboxylic acid ethyl ester
3-[benzyl-(3,5-dimethyl-pyrazol-1-ylmethyl)-amino]-propionitrile

General Description

3-(Benzylamino)propionitrile undergoes aza-type Michael reaction with 1-hydroxymethyl-5-methyl-1H-pyrazole-3-carboxylic acid ethyl ester under mild conditions.

Properties of 3-(BENZYLAMINO)PROPIONITRILE

Melting point:	70 °C
Boiling point:	276.13°C (rough estimate)
Density	1.024 g/mL at 25 °C (lit.)
refractive index	n20/D 1.5308(lit.)
Flash point:	>230 °F
storage temp.	Refrigerator
solubility	Soluble in DMSO.
form	Liquid
pka	7.29±0.19(Predicted)
Specific Gravity	1.024
color	Clear Colorless
CAS DataBase Reference	706-03-6

Safety information for 3-(BENZYLAMINO)PROPIONITRILE

Signal word	Warning
Pictogram(s)	Exclamation Mark Irritant GHS07
GHS Hazard Statements	H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes	P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.