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CAS No.: | 7146-85-2 |
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Name: | 2-bromo-2-ethyl-1-(morpholin-4-yl)butan-1-one |
Molecular Structure: | |
Formula: | C10H18BrNO2 |
Molecular Weight: | 264.1594 |
Synonyms: | Morpholine, 4-(2-bromo-2-ethylbutyryl)- (8CI);NSC 60222; |
Density: | 1.326 g/cm3 |
Boiling Point: | 342.6 °C at 760 mmHg |
Flash Point: | 161 °C |
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The 1-Butanone,2-bromo-2-ethyl-1-(4-morpholinyl)-, with the CAS registry number 7146-85-2, is also known as Morpholine, 4-(2-bromo-2-ethylbutyryl)- (8CI). This chemical's molecular formula is C10H18BrNO2 and molecular weight is 264.1594. What's more, its systematic name is called 2-Bromo-2-ethyl-1-(morpholin-4-yl)butan-1-one.
Physical properties about 1-Butanone,2-bromo-2-ethyl-1-(4-morpholinyl)- are: (1)ACD/LogP: 2.13; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 29.54 Å2; (7)Index of Refraction: 1.505; (8)Molar Refractivity: 59.05 cm3; (9)Molar Volume: 199 cm3; (10)Surface Tension: 40.4 dyne/cm; (11)Density: 1.326 g/cm3; (12)Flash Point: 161 °C; (13)Enthalpy of Vaporization: 58.64 kJ/mol; (14)Boiling Point: 342.6 °C at 760 mmHg; (15)Vapour Pressure: 7.43E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N1CCOCC1)C(Br)(CC)CC
(2) InChI: InChI=1/C10H18BrNO2/c1-3-10(11,4-2)9(13)12-5-7-14-8-6-12/h3-8H2,1-2H3
(3) InChIKey: ZAVSIBPANORZOP-UHFFFAOYAL