Name: N,N-DIISOBUTYLFORMAMIDE
SKU: 2591-76-6

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Basic Information

Molecular Structure:
CAS No.:	2591-76-6
Name:	N,N-DIISOBUTYLFORMAMIDE
Article Data:	15

Formula:	C₉H₁₉NO
Molecular Weight:	157.256
Synonyms:	Formamide,N,N-diisobutyl- (6CI,7CI,8CI);N,N-Diisobutylformamide;
EINECS:	219-983-4
Density:	0.862 g/cm³
Boiling Point:	245.5 °C at 760 mmHg
Flash Point:	91.9 °C
Solubility:	13g/L at 20℃
Safety:	23-24/25
PSA:	20.31000
LogP:	2.39270

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Specification

The CAS registry number of Formamide,N,N-bis(2-methylpropyl)- is 2591-76-6. The IUPAC name is N,N-bis(2-methylpropyl)formamide. Its EINECS registry number is 219-983-4. In addition, the molecular formula is C₉H₁₉NO and the molecular weight is 157.25.

Physical properties about Formamide,N,N-bis(2-methylpropyl)- are: (1)ACD/LogP: 1.81; (2)ACD/LogD (pH 5.5): 1.81; (3)ACD/LogD (pH 7.4): 1.81; (4)ACD/BCF (pH 5.5): 13.99; (5)ACD/BCF (pH 7.4): 13.99; (6)ACD/KOC (pH 5.5): 230.01; (7)ACD/KOC (pH 7.4): 230.01; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 20.31 Å²; (11)Index of Refraction: 1.434; (12)Molar Refractivity: 47.57 cm³; (13)Molar Volume: 182.4 cm³; (14)Polarizability: 18.85 ×10^-24cm³; (15)Surface Tension: 27.9 dyne/cm; (16)Density: 0.862 g/cm³; (17)Flash Point: 91.9 °C; (18)Enthalpy of Vaporization: 48.26 kJ/mol; (19)Boiling Point: 245.5 °C at 760 mmHg; (20)Vapour Pressure: 0.0287 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
During using it, do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer). And you should avoid contact with skin and eyes.

You can still convert the following datas into molecular structure:
(1)SMILES: O=CN(CC(C)C)CC(C)C
(2)InChI: InChI=1/C9H19NO/c1-8(2)5-10(7-11)6-9(3)4/h7-9H,5-6H2,1-4H3
(3)InChIKey: NTYICSDTCGMBQM-UHFFFAOYAK