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| CAS No.: | 85959-38-2 |
|---|---|
| Name: | 4-[[1-[[(4-chloro-o-tolyl)amino]carbonyl]-2-oxopropyl]azo]-N-[4-[[1-[[(4-chloro-o-tolyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]benzamide |
| Molecular Structure: | |
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| Formula: | C35H31Cl2N7O5 |
| Molecular Weight: | 700.57 |
| Synonyms: | 4-((1-(((4-Chloro-o-tolyl)amino)carbonyl)-2-oxopropyl)azo)-N-(4-((1-(((4-chloro-o-tolyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)benzamide;4-[[1-(4-Chloro-2-methylanilino)-1,3-dioxobutan-2-yl]diazenyl]-N-[4-[[1-(4-chloro-2-methylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]benzamide; |
| EINECS: | 289-031-0 |
| Density: | 1.36 g/cm3 |
| Boiling Point: | 779.3 °C at 760 mmHg |
| Flash Point: | 425.1 °C |
| PSA: | 174.37000 |
| LogP: | 8.75250 |
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
- 90221-55-92-bromo-5-methylbenzaldehyde
- 885590-99-82,3-DIFLUORO-4-IODOBENZALDEHYDE
- 97730-31-9(S)-4'-(2-Methylbutyl)Biphenyl-4-Carbonitrile
- 926293-55-26-Bromo-2-methylpyridine-3-carboxaldehyde
- 911112-05-55-Iodo-3-(trifluoromethyl)-2-pyridinamine
- 886364-50-71-(5-Bromo-2-pyridinyl)-2,2,2-trifluoroethanone
- Total:4 Page 1 of 1 1
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Specification
The 4-[1-[(4-Chloro-2-methyl-phenyl)carbamoyl]-2-oxo-propyl]diazenyl-N-[4-[1-[(4-chloro-2-methyl-phenyl)carbamoyl]-2-oxo-propyl]diazenylphenyl]benzamide, with the CAS registry number 85959-38-2, is also known as 4-((1-(((4-Chloro-o-tolyl)amino)carbonyl)-2-oxopropyl)azo)-N-(4-((1-(((4-chloro-o-tolyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)benzamide. Its EINECS number is 289-031-0. This chemical's molecular formula is C35H31Cl2N7O5 and molecular weight is 700.57. What's more, its systematic name is 4-[[1-(4-chloro-2-methylanilino)-1,3-dioxobutan-2-yl]diazenyl]-N-[4-[[1-(4-chloro-2-methylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]benzamide.
Physical properties of 4-[1-[(4-Chloro-2-methyl-phenyl)carbamoyl]-2-oxo-propyl]diazenyl-N-[4-[1-[(4-chloro-2-methyl-phenyl)carbamoyl]-2-oxo-propyl]diazenylphenyl]benzamide are: (1)ACD/LogP: 9.35; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 9.3; (4)ACD/LogD (pH 7.4): 8.13; (5)#H bond acceptors: 12; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 12; (8)Polar Surface Area: 170.88 Å2; (9)Index of Refraction: 1.649; (10)Molar Refractivity: 187.76 cm3; (11)Molar Volume: 514.9 cm3; (12)Polarizability: 74.43×10-24cm3; (13)Surface Tension: 51.6 dyne/cm; (14)Density: 1.36 g/cm3; (15)Flash Point: 425.1 °C; (16)Enthalpy of Vaporization: 113.4 kJ/mol; (17)Boiling Point: 779.3 °C at 760 mmHg; (18)Vapour Pressure: 3.15E-24 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C=CC(=C1)Cl)NC(=O)C(C(=O)C)N=NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)Cl)C
(2)InChI: InChI=1S/C35H31Cl2N7O5/c1-19-17-24(36)7-15-29(19)39-34(48)31(21(3)45)43-41-27-9-5-23(6-10-27)33(47)38-26-11-13-28(14-12-26)42-44-32(22(4)46)35(49)40-30-16-8-25(37)18-20(30)2/h5-18,31-32H,1-4H3,(H,38,47)(H,39,48)(H,40,49)
(3)InChIKey: MLAZNTLPLAACNH-UHFFFAOYSA-N