CAS No.24731-73-5,N,N'-(1,4-Phenylene)bis(acetoacetamide) Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	24731-73-5
Name:	N,N'-(1,4-Phenylene)bis(acetoacetamide)
Article Data:	7

Formula:	C₁₄H₁₆N₂O₄
Molecular Weight:	276.292
Synonyms:	Acetoacetamide,N,N'-p-phenylenebis- (6CI);1,4-Bis(acetoacetamido)benzene;1,4-Bis(acetoacetylamino)benzene;NSC 87597;
EINECS:	246-438-8
Density:	1.279 g/cm³
Melting Point:	355 °C (decomp)
Boiling Point:	582.2 °C at 760 mmHg
Flash Point:	234.4 °C
Solubility:	212mg/L at 20℃
Appearance:	White to grey-brown powder
PSA:	92.34000
LogP:	1.66780

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Specification

This chemical is called Butanamide, N,N'-1,4-phenylenebis[3-oxo-, and its systematic name is N,N'-benzene-1,4-diylbis(3-oxobutanamide). With the molecular formula of C₁₄H₁₆N₂O₄, its molecular weight is 276.29. The CAS registry number of this chemical is 24731-73-5. Additionally, its product category is Intermediates of Dyes and Pigments.

Other characteristics of the Butanamide, N,N'-1,4-phenylenebis[3-oxo- can be summarised as followings: (1)ACD/LogP: -0.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.92; (4)ACD/LogD (pH 7.4): -0.92; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 7.51; (8)ACD/KOC (pH 7.4): 7.47; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 74.76 Å²; (13)Index of Refraction: 1.595; (14)Molar Refractivity: 73.38 cm³; (15)Molar Volume: 215.8 cm³; (16)Polarizability: 29.09×10^-24cm³; (17)Surface Tension: 53.5 dyne/cm; (18)Density: 1.279 g/cm³; (19)Flash Point: 234.4 °C; (20)Enthalpy of Vaporization: 87.04 kJ/mol; (21)Boiling Point: 582.2 °C at 760 mmHg; (22)Vapour Pressure: 1.52E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(Nc1ccc(cc1)NC(=O)CC(=O)C)CC(=O)C
2.InChI: InChI=1/C14H16N2O4/c1-9(17)7-13(19)15-11-3-5-12(6-4-11)16-14(20)8-10(2)18/h3-6H,7-8H2,1-2H3,(H,15,19)(H,16,20)
3.InChIKey: OWGNKUKYZPVEFS-UHFFFAOYAU