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CAS No.: | 73718-62-4 |
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Name: | 1-Ethyl-2-methylene-3,3-dimethylindoline |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C13H17N |
Molecular Weight: | 187.285 |
Synonyms: | Indoline,1-ethyl-3,3-dimethyl-2-methylene- (6CI);1-Ethyl-3,3-dimethyl-2-methylidene-2,3-dihydro-1H-indole; |
Density: | 0.996 g/cm3 |
Boiling Point: | 258.095 °C at 760 mmHg |
Flash Point: | 100.461 °C |
PSA: | 3.24000 |
LogP: | 3.38280 |
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The CAS registry number of 1H-Indole,1-ethyl-2,3-dihydro-3,3-dimethyl-2-methylene- is 73718-62-4. The systematic name is 1-ethyl-3,3-dimethyl-2-methylidene-2,3-dihydro-1H-indole. In addition, the molecular formula is C13H17N and the molecular weight is 187.28. It should be stored in a cool and dry place.
Physical properties about 1H-Indole,1-ethyl-2,3-dihydro-3,3-dimethyl-2-methylene- are: (1)ACD/LogP: 3.55 ; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 370; (5)ACD/BCF (pH 7.4): 370; (6)ACD/KOC (pH 5.5): 2397; (7)ACD/KOC (pH 7.4): 2398; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 3.24 Å2; (11)Index of Refraction: 1.557; (12)Molar Refractivity: 60.541 cm3; (13)Molar Volume: 188.007 cm3; (14)Polarizability: 24 ×10-24cm3; (15)Surface Tension: 36.093 dyne/cm; (16)Density: 0.996 g/cm3; (17)Flash Point: 100.461 °C; (18)Enthalpy of Vaporization: 49.568 kJ/mol; (19)Boiling Point: 258.095 °C at 760 mmHg; (20)Vapour Pressure: 0.014 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC2(C)c1ccccc1N(CC)C2=C
(2)InChI: InChI=1/C13H17N/c1-5-14-10(2)13(3,4)11-8-6-7-9-12(11)14/h6-9H,2,5H2,1,3-4H3
(3)InChIKey: MWYTVFRHPLPLKF-UHFFFAOYAT