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CAS No.: | 808760-02-3 |
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Name: | 2-AMINO-3-BROMOBENZOPHENONE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C13H10BrNO |
Molecular Weight: | 276.13 |
Synonyms: | Acetophenone,2-amino-3-bromo- (4CI);2-amino-3-bromobenzophenone;2-amino-3-bromophenyl phenyl ketone; |
Density: | 1.484 g/cm3 |
Boiling Point: | 425.504 °C at 760 mmHg |
Flash Point: | 211.138 °C |
PSA: | 43.09000 |
LogP: | 3.84350 |
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The CAS register number of Ethanone,1-(2-amino-3-bromophenyl)- is 808760-02-3. It also can be called as 2-amino-3-bromophenyl phenyl ketone and the systematic name about this chemical is (2-amino-3-bromo-phenyl)-phenyl-methanone. The molecular formula about this chemical is C13H10BrNO and molecular weight is 276.13.
Physical properties about Ethanone,1-(2-amino-3-bromophenyl)- are: (1)ACD/LogP: 3.82; (2)ACD/LogD (pH 5.5): 3.815; (3)ACD/LogD (pH 7.4): 3.815; (4)ACD/BCF (pH 5.5): 466.688; (5)ACD/BCF (pH 7.4): 466.688; (6)ACD/KOC (pH 5.5): 2831.998; (7)ACD/KOC (pH 7.4): 2831.998; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 43.09Å2; (12)Index of Refraction: 1.652; (13)Molar Refractivity: 67.972 cm3; (14)Molar Volume: 186.013 cm3; (15)Polarizability: 26.946x10-24cm3; (16)Surface Tension: 53.57 dyne/cm; (17)Enthalpy of Vaporization: 68.016 kJ/mol; (18)Boiling Point: 425.504 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)C(=O)c2cccc(c2N)Br
(2)InChI: InChI=1/C13H10BrNO/c14-11-8-4-7-10(12(11)15)13(16)9-5-2-1-3-6-9/h1-8H,15H2
(3)InChIKey: RUSKHLGGXZTJFK-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C13H10BrNO/c14-11-8-4-7-10(12(11)15)13(16)9-5-2-1-3-6-9/h1-8H,15H2
(5)Std. InChIKey: RUSKHLGGXZTJFK-UHFFFAOYSA-N