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Name |
Ethanone,2-[(4-bromophenyl)amino]-1-phenyl- |
EINECS | N/A |
CAS No. | 4831-21-4 | Density | 1.443 g/cm3 |
PSA | 29.10000 | LogP | 3.81690 |
Solubility | N/A | Melting Point |
158-160 °C |
Formula | C14H12BrNO | Boiling Point | 438.6 °C at 760 mmHg |
Molecular Weight | 290.159 | Flash Point | 219.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Acetophenone,2-(p-bromoanilino)- (7CI,8CI);2-(4-Bromoanilino)-1-phenyl-1-ethanone; |
Article Data | 9 |
The CAS register number of Ethanone,2-[(4-bromophenyl)amino]-1-phenyl- is 4831-21-4. It also can be called as 2-(4-Bromoanilino)-1-phenyl-1-ethanone and the systematic name about this chemical is 2-[(4-bromophenyl)amino]-1-phenylethanone. The molecular formula about this chemical is C14H12BrNO and the molecular weight is 290.15518. This chemical is irritant. It may cause inflammation to the skin or other mucous membranes.
Physical properties about Ethanone,2-[(4-bromophenyl)amino]-1-phenyl- are: (1)ACD/LogP: 3.84; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 20.31 Å2; (6)Index of Refraction: 1.648; (7)Molar Refractivity: 73.15 cm3; (8)Molar Volume: 200.9 cm3; (9)Polarizability: 28.99x10-24cm3; (10)Surface Tension: 51 dyne/cm; (11)Density: 1.443 g/cm3; (12)Flash Point: 219.1 °C; (13)Enthalpy of Vaporization: 69.54 kJ/mol; (14)Boiling Point: 438.6 °C at 760 mmHg; (15)Vapour Pressure: 6.82E-08 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc(NCC(=O)c1ccccc1)cc2
(2)InChI: InChI=1/C14H12BrNO/c15-12-6-8-13(9-7-12)16-10-14(17)11-4-2-1-3-5-11/h1-9,16H,10H2
(3)InChIKey: LPKCHKLRDTZTHS-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C14H12BrNO/c15-12-6-8-13(9-7-12)16-10-14(17)11-4-2-1-3-5-11/h1-9,16H,10H2
(5)Std. InChIKey: LPKCHKLRDTZTHS-UHFFFAOYSA-N