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| Name |
N,N'-(3,3'-Dimethyl-4,4'-biphenyldiyl)bis(3-oxobutanamide) |
EINECS | 202-111-1 |
| CAS No. | 91-96-3 | Density | 1.212 g/cm3 |
| PSA | 92.34000 | LogP | 3.95160 |
| Solubility | N/A | Melting Point |
200 °C |
| Formula | C22H24N2O4 | Boiling Point | 612.6 °C at 760 mmHg |
| Molecular Weight | 380.444 | Flash Point | 199.9 °C |
| Transport Information | N/A | Appearance | powder |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
4',4'''-Bi-o-acetoacetotoluidide(6CI,7CI,8CI);3,3'-Dimethyl-4,4'-bis(acetoacetylamino)biphenyl;4,4'-Bis(acetoacetamido)-3,3'-dimethyl-1,1'-biphenyl;4,4'-Bis(o-acetoacetotoluidide);Acna Naphthol G;Amanil Naphthol AS-G;Amarthol AS-G;Arlanthol ASG;C.I. 37610;C.I. Azoic Coupling Component 5;Cibanaphthol AG;Conazoic E;Daito Grounder G;DycostholAS-G;Hebeithol AS-G;Kambothol ASG;Kiwa Grounder G;N,N'-Bis(acetoacetyl)-3,3'-dimethylbenzidine;NSC 37212;Naftol AS-G;Naphtanilide G;Naphthanil G;NaphthoideG;Naphthol AS-G Supra;Naphtoelan G;Naphtol AS-G;Napthol ASG;SanatolAS-G;Sanatol G;Tulathol AS-G;Ultrazol G;p,p'-Bis(o-acetoacetotoluidide); |
N,N'-(3,3'-Dimethyl-4,4'-biphenyldiyl)bis(3-oxobutanamide) Specification
The cas register number of N,N'-(3,3'-Dimethyl-4,4'-biphenyldiyl)bis(3-oxobutanamide) is 91-96-3. It also can be called as 4,4'-Biphenyldiamine, N,N'-diacetoacetyl-3,3'-dimethyl- and the Systematic name about this chemical is N-[2-methyl-4-[3-methyl-4-(3-oxobutanoylamino)phenyl]phenyl]-3-oxobutanamide. It is used as intermediate for the manufacture of organic pigments and dyestuffs. Attributes Contact us for further information Contact.
Physical properties about N,N'-(3,3'-Dimethyl-4,4'-biphenyldiyl)bis(3-oxobutanamide) are: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.76; (4)ACD/LogD (pH 7.4): 2.75; (5)ACD/BCF (pH 5.5): 74.33; (6)ACD/BCF (pH 7.4): 71.29; (7)ACD/KOC (pH 5.5): 760.2; (8)ACD/KOC (pH 7.4): 729.09; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 74.76Å2; (13)Index of Refraction: 1.602; (14)Molar Refractivity: 107.62 cm3; (15)Molar Volume: 313.7 cm3; (16)Surface Tension: 49.6 dyne/cm; (17)Density: 1.212 g/cm3; (18)Flash Point: 199.9 °C; (19)Enthalpy of Vaporization: 90.94 kJ/mol; (20)Boiling Point: 612.6 °C at 760 mmHg; (21)Vapour Pressure: 6.04E-15 mmHg at 25°C.
Uses of N,N'-(3,3'-Dimethyl-4,4'-biphenyldiyl)bis(3-oxobutanamide): It reacts with 11-amino-3-bromo-13H-acenaphtho[1,2-e]pyridazino[3,2-b]quinazoline-13-one to get C43H32BrN7O5. This reaction needs solvent alkaline aq. solution. The yield is 85 %.
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People can use the following data to convert to the molecule structure.
1.SMILES: O=C(Nc1ccc(cc1C)c2ccc(NC(=O)CC(=O)C)c(c2)C)CC(=O)C
2.InChI: InChI=1/C22H24N2O4/c1-13-9-17(5-7-19(13)23-21(27)11-15(3)25)18-6-8-20(14(2)10-18)24-22(28)12-16(4)26/h5-10H,11-12H2,1-4H3,(H,23,27)(H,24,28)
3.InChIKey: CRRLDLPBQWRVGN-UHFFFAOYAH
4.Std. InChI: InChI=1S/C22H24N2O4/c1-13-9-17(5-7-19(13)23-21(27)11-15(3)25)18-6-8-20(14(2)10-18)24-22(28)12-16(4)26/h5-10H,11-12H2,1-4H3,(H,23,27)(H,24,28)
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