Acetonitrile,2-[bis(1-methylethyl)amino]- supplier

Name
DIISOPROPYLAMINOACETONITRILE
EINECS
CAS No. 54714-49-7
Article Data8
CAS DataBase
Density 0.865 g/cm³
Solubility
Melting Point
Formula C₈H₁₆N₂
Boiling Point 204.7 °C at 760 mmHg
Molecular Weight 140.228
Flash Point 67.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols C
Synonyms Acetonitrile,[bis(1-methylethyl)amino]- (9CI);Diisopropylaminoacetonitrile;NSC 26718;
PSA 27.03000
LogP 1.62878

Acetonitrile,2-[bis(1-methylethyl)amino]- Specification

The Acetonitrile,2-[bis(1-methylethyl)amino]-, with the CAS registry number 54714-49-7, is also known as 2,3,4,9-Tetrahydro-1h-benzo[b]fluoren-5-olate. This chemical's molecular formula is C₈H₁₆N₂ and molecular weight is 140.226. Its systematic name is called (dipropan-2-ylamino)acetonitrile. When you are using this chemical, please be cautious about it. It may destroy living tissue on contact.

Physical properties of Acetonitrile,2-[bis(1-methylethyl)amino]-: (1)ACD/LogP: 1.30; (2)#H bond acceptors: 2; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 3; (5)Index of Refraction: 1.439; (6)Molar Refractivity: 42.66 cm³; (7)Molar Volume: 161.9 cm³; (8)Surface Tension: 30 dyne/cm; (9)Density: 0.865 g/cm³; (10)Flash Point: 67.4 °C; (11)Enthalpy of Vaporization: 44.09 kJ/mol; (12)Boiling Point: 204.7 °C at 760 mmHg; (13)Vapour Pressure: 0.26 mmHg at 25°C.

Uses of Acetonitrile,2-[bis(1-methylethyl)amino]-: it can be used to produce [(5-chloro-3-oxo-3H-[1,2]dithiol-4-yl)-isopropyl-amino]-acetonitrile at temperature of 0 °C. This reaction will need reagent S₂C_l2, DABCO, formic acid and solvent CHCl₃ with reaction time of 3 days. The yield is about 20%.

You can still convert the following datas into molecular structure:
(1)SMILES: N#CCN(C(C)C)C(C)C
(2)InChI: InChI=1/C8H16N2/c1-7(2)10(6-5-9)8(3)4/h7-8H,6H2,1-4H3
(3)InChIKey: KRHUHTLKXFFVGB-UHFFFAOYAV

Product Name

DIISOPROPYLAMINOACETONITRILE

Acetonitrile,2-[bis(1-methylethyl)amino]- Specification

Related Products

Hot Products