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Name |
Methanone,(2-amino-3,5-dibromophenyl)phenyl- |
EINECS | N/A |
CAS No. | 69751-74-2 | Density | 1.755 g/cm3 |
PSA | 43.09000 | LogP | 4.60600 |
Solubility | N/A | Melting Point |
N/A |
Formula | C13H9Br2NO | Boiling Point | 459.7 °C at 760 mmHg |
Molecular Weight | 355.029 | Flash Point | 231.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Amino-3,5-dibromobenzophenone;(2-amino-3,5-dibromophenyl)(phenyl)methanone;methanone, (2-amino-3,5-dibromophenyl)phenyl-; |
Article Data | 4 |
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