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CAS No.: | 112522-64-2 |
---|---|
Name: | 4-Acetylamino-N-(2'-aminophenyl)benzamide |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C15H14N2O2 |
Molecular Weight: | 269.303 |
Synonyms: | Acetyldinaline;PD 123654;Tacedinaline;CI 994;Goe 5549; |
EINECS: | 200-256-5 |
Density: | 1.322 g/cm3 |
Melting Point: | 216.1 °C |
Boiling Point: | 450.6 °C at 760 mmHg |
Flash Point: | 226.3 °C |
Appearance: | white |
Hazard Symbols: | Xi |
Risk Codes: | 36 |
Safety: | 26 |
PSA: | 84.22000 |
LogP: | 3.20670 |
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The Molecular Structure of 4-Acetylamino-N-(2'-aminophenyl)benzamide (CAS NO.112522-64-2):
Empirical Formula: C15H15N3O2
Molecular Weight: 269.2985
IUPAC Name: 4-acetamido-N-(2-aminophenyl)benzamide
Classification Code: Combination therapy for selected tumors including non-small cell lung, pancreatic, breast, and colorectal cancers
Nominal Mass: 269 Da
Average Mass: 269.2985 Da
Monoisotopic Mass: 269.116427 Da
Index of Refraction: 1.707
Molar Refractivity: 79.33 cm3
Molar Volume: 203.6 cm3
Surface Tension: 64.1 dyne/cm
Density: 1.322 g/cm3
Flash Point: 226.3 °C
Enthalpy of Vaporization: 70.95 kJ/mol
Boiling Point: 450.6 °C at 760 mmHg
Vapour Pressure: 2.6E-08 mmHg at 25°C
InChI
InChI=1/C15H15N3O2/c1-10(19)17-12-8-6-11(7-9-12)15(20)18-14-5-3-2-4-13(14)16/h2-9H,16H2,1H3,(H,17,19)(H,18,20)
Smiles
c1cc(C(Nc2c(cccc2)N)=O)ccc1NC(=O)C
Synonyms: Tacedinaline [USAN:INN] ; Acetyldinaline ; Benzamide, 4-(acetylamino)-N-(2-aminophenyl)- ; C.I. 994 ; CI 994 ; CI-994 ; Goe 5549 ; PD 123654 ; Tacedinalina ; Tacedinalina [INN-Spanish] ; Tacedinaline ; UNII-UMF554N5FG