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CAS No.: | 82962-91-2 |
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Name: | 1-AMINO-3,3-DIMETHYL-BUTAN-2-ONE |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C6H13NO |
Molecular Weight: | 115.175 |
Synonyms: | 1-Amino-3,3-dimethylbutan-2-one; |
Density: | 0.896 g/cm3 |
Boiling Point: | 155.5 °C at 760 mmHg |
Flash Point: | 47.8 °C |
PSA: | 43.09000 |
LogP: | 1.26060 |
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The 1-Amino-3,3-dimethyl-2-butanone with its cas register number is 82962-91-2. It also can be called as 2-Butanone,1-amino-3,3-dimethyl- and the Systematic name about this chemical is 1-amino-3,3-dimethylbutan-2-one.
Physical properties about 1-Amino-3,3-dimethyl-2-butanone are: (1)ACD/LogP: 0.33 ; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 20.31Å2; (6)Index of Refraction: 1.433; (7)Molar Refractivity: 33.37 cm3; (8)Molar Volume: 128.4 cm3; (9)Polarizability: 13.23x10-24cm3; (10)Surface Tension: 29.8 dyne/cm; (11)Enthalpy of Vaporization: 39.22 kJ/mol; (12)Vapour Pressure: 3.03 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(C(C)(C)C)CN
(2)InChI: InChI=1/C6H13NO/c1-6(2,3)5(8)4-7/h4,7H2,1-3H3
(3)InChIKey: CRTRUQUJSMFWPD-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C6H13NO/c1-6(2,3)5(8)4-7/h4,7H2,1-3H3
(5)Std. InChIKey: CRTRUQUJSMFWPD-UHFFFAOYSA-N