Products Categories
CAS No.: | 29124-56-9 |
---|---|
Name: | 1-(2-amino-5-bromophenyl)ethanone |
Article Data: | 46 |
Molecular Structure: | |
Formula: | C8H8BrNO |
Molecular Weight: | 214.062 |
Synonyms: | Acetophenone,2'-amino-5'-bromo- (8CI);1-(2-Amino-5-bromophenyl)ethanone;2-Amino-5-bromoacetophenone;2'-Amino-5'-bromoacetophenone; |
Density: | 1.535 g/cm3 |
Melting Point: | 86-88 °C |
Boiling Point: | 302.244 °C at 760 mmHg |
Flash Point: | 136.592 °C |
PSA: | 43.09000 |
LogP: | 2.81510 |
What can I do for you?
Get Best Price
The 2'-Amino-5'-bromoacetophenone, with the CAS registry number 29124-56-9, has the systematic name of 1-(2-amino-5-bromophenyl)ethanone. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C8H8BrNO.
The characteristics of 2'-Amino-5'-bromoacetophenone are as followings: (1)ACD/LogP: 2.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 90; (6)ACD/BCF (pH 7.4): 90; (7)ACD/KOC (pH 5.5): 871; (8)ACD/KOC (pH 7.4): 872; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 43.09 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 48.207 cm3; (15)Molar Volume: 139.429 cm3; (16)Polarizability: 19.111×10-24cm3; (17)Surface Tension: 48.942 dyne/cm; (18)Density: 1.535 g/cm3; (19)Flash Point: 136.592 °C; (20)Enthalpy of Vaporization: 54.244 kJ/mol; (21)Boiling Point: 302.244 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Nc1ccc(Br)cc1C(C)=O
(2)InChI: InChI=1/C8H8BrNO/c1-5(11)7-4-6(9)2-3-8(7)10/h2-4H,10H2,1H3
(3)InChIKey: JCGVHKOIDFMQER-UHFFFAOYAH