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69751-74-2

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Basic Information
CAS No.: 69751-74-2
Name: 2-AMINO-3,5-DIBROMOBENZOPHENONE
Article Data: 4
Molecular Structure:
Molecular Structure of 69751-74-2 (2-AMINO-3,5-DIBROMOBENZOPHENONE)
Formula: C13H9Br2NO
Molecular Weight: 355.029
Synonyms: 2-Amino-3,5-dibromobenzophenone;(2-amino-3,5-dibromophenyl)(phenyl)methanone;methanone, (2-amino-3,5-dibromophenyl)phenyl-;
Density: 1.755 g/cm3
Boiling Point: 459.7 °C at 760 mmHg
Flash Point: 231.8 °C
PSA: 43.09000
LogP: 4.60600
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Specification

The Methanone,(2-amino-3,5-dibromophenyl)phenyl-, with the CAS registry number 69751-74-2, has the systematic name of (2-amino-3,5-dibromophenyl)(phenyl)methanone. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C13H9Br2NO.

The characteristics of Methanone,(2-amino-3,5-dibromophenyl)phenyl- are as followings: (1)ACD/LogP: 5.23; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.22; (4)ACD/LogD (pH 7.4): 5.22; (5)ACD/BCF (pH 5.5): 5505.2; (6)ACD/BCF (pH 7.4): 5505.2; (7)ACD/KOC (pH 5.5): 16566.77; (8)ACD/KOC (pH 7.4): 16566.77; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.671; (14)Molar Refractivity: 75.66 cm3; (15)Molar Volume: 202.1 cm3; (16)Polarizability: 29.99×10-24cm3; (17)Surface Tension: 56.2 dyne/cm; (18)Density: 1.755 g/cm3; (19)Flash Point: 231.8 °C; (20)Enthalpy of Vaporization: 72.02 kJ/mol; (21)Boiling Point: 459.7 °C at 760 mmHg; (22)Vapour Pressure: 1.24E-08 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc2cc(Br)cc(C(=O)c1ccccc1)c2N
(2)InChI: InChI=1/C13H9Br2NO/c14-9-6-10(12(16)11(15)7-9)13(17)8-4-2-1-3-5-8/h1-7H,16H2
(3)InChIKey: IMLLZDZNMSFUSJ-UHFFFAOYAX