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CAS No.: | 1823-62-7 |
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Name: | 4-[2-N,N-DIETHYLETHOXY]PHENYL BROMIDE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C12H18BrNO |
Molecular Weight: | 272.185 |
Synonyms: | 1-Bromo-4-(diethylaminoethoxy)benzene;2-(p-Bromophenoxy)triethylamine;Triethylamine,2-(p-bromophenoxy)- (7CI,8CI);2-(4-Bromophenoxy)triethylamine;4-(2-Diethylaminoethoxy)phenyl bromide; |
Density: | 1.24 g/cm3 |
Boiling Point: | 319.5 °C at 760 mmHg |
Flash Point: | 147 °C |
PSA: | 12.47000 |
LogP: | 3.16970 |
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This chemical is called Ethanamine, 2-(4-bromophenoxy)-N,N-diethyl-, and its systematic name is 2-(4-bromophenoxy)-N,N-diethylethanamine. With the molecular formula of C12H18BrNO, its molecular weight is 272.18. The CAS registry number of this chemical is 1823-62-7.
Other characteristics of the Ethanamine, 2-(4-bromophenoxy)-N,N-diethyl- can be summarised as followings: (1)ACD/LogP: 4.09; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.527; (8)Molar Refractivity: 67.5 cm3; (9)Molar Volume: 219.4 cm3; (10)Polarizability: 26.76×10-24cm3; (11)Surface Tension: 36.4 dyne/cm; (12)Density: 1.24 g/cm3; (13)Flash Point: 147 °C; (14)Enthalpy of Vaporization: 56.1 kJ/mol; (15)Boiling Point: 319.5 °C at 760 mmHg; (16)Vapour Pressure: 0.000338 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Brc1ccc(OCCN(CC)CC)cc1
2.InChI: InChI=1/C12H18BrNO/c1-3-14(4-2)9-10-15-12-7-5-11(13)6-8-12/h5-8H,3-4,9-10H2,1-2H3
3.InChIKey: XKIFTEHOCFPRJE-UHFFFAOYAX