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CAS No.: | 33543-62-3 |
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Name: | [2-(3-METHOXY-PHENYL)-ETHYL]-METHYL-AMINE |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C10H15NO |
Molecular Weight: | 165.235 |
Synonyms: | Phenethylamine,m-methoxy-N-methyl- (6CI,8CI);[2-(3-Methoxyphenyl)ethyl]methylamine;m-Methoxy-N-methylphenethylamine;3-Methoxy-N-methylbenzeneethanamine; |
EINECS: | 251-570-4 |
Density: | 0.963 g/cm3 |
Boiling Point: | 250.8 °C at 760 mmHg |
Flash Point: | 99.1 °C |
PSA: | 21.26000 |
LogP: | 1.84800 |
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The CAS register number of Benzeneethanamine,3-methoxy-N-methyl- is 33543-62-3. It also can be called as 3-Methoxy-N-methylbenzeneethanamine and the systematic name about this chemical is 2-(3-methoxyphenyl)-N-methylethanamine. The molecular formula about this chemical is C10H15NO and the molecular weight is 165.2322.
Physical properties about Benzeneethanamine,3-methoxy-N-methyl- are: (1)ACD/LogP: 1.51; (2)ACD/LogD (pH 5.5): -1.58; (3)ACD/LogD (pH 7.4): -1.18; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 12.47 Å2; (12)Index of Refraction: 1.502; (13)Molar Refractivity: 50.7 cm3; (14)Molar Volume: 171.5 cm3; (15)Polarizability: 20.1x10-24cm3; (16)Surface Tension: 32 dyne/cm; (17)Density: 0.963 g/cm3; (18)Flash Point: 99.1 °C; (19)Enthalpy of Vaporization: 48.81 kJ/mol; (20)Boiling Point: 250.8 °C at 760 mmHg; (21)Vapour Pressure: 0.0213 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(ccc1)CCNC)C
(2)InChI: InChI=1/C10H15NO/c1-11-7-6-9-4-3-5-10(8-9)12-2/h3-5,8,11H,6-7H2,1-2H3
(3)InChIKey: MCGDBHZRFQKLBT-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C10H15NO/c1-11-7-6-9-4-3-5-10(8-9)12-2/h3-5,8,11H,6-7H2,1-2H3
(5)Std. InChIKey: MCGDBHZRFQKLBT-UHFFFAOYSA-N