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CAS No.: | 102503-23-1 |
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Name: | N-(2,4-DIMETHOXYBENZYL)-N-METHYLAMINE |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C10H15NO2 |
Molecular Weight: | 181.235 |
Synonyms: | (2,4-Dimethoxybenzyl)methylamine;N-Methyl(2,4-dimethoxybenzyl)amine; |
Density: | 1.012 g/cm3 |
Boiling Point: | 262.1 °C at 760 mmHg |
Flash Point: | 104.6 °C |
Hazard Symbols: | R36/37/38:; |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 30.49000 |
LogP: | 1.81410 |
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The IUPAC name of Benzenemethanamine,2,4-dimethoxy-N-methyl- is 1-(2,4-dimethoxyphenyl)-N-methylmethanamine. With the CAS registry number 102503-23-1, it is also named as (2,4-Dimethoxybenzyl)methylamine. In addition, its molecular formula is C10H15NO2 and its molecular weight is 181.23.
The other characteristics of Benzenemethanamine,2,4-dimethoxy-N-methyl- can be summarized as: (1)ACD/LogP: 1.23; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 21.7 Å2; (7)Index of Refraction: 1.5; (8)Molar Refractivity: 52.75 cm3; (9)Molar Volume: 179 cm3; (10)Polarizability: 20.91×10-24cm3; (11)Surface Tension: 31.7 dyne/cm; (12)Density: 1.012 g/cm3; (13)Flash Point: 104.6 °C; (14)Enthalpy of Vaporization: 49.98 kJ/mol; (15)Boiling Point: 262.1 °C at 760 mmHg; (16)Vapour Pressure: 0.0111 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following: it is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing, gloves and eye/face protection. Moreover, in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
People can use the following data to convert to the molecule structure.
(1)SMILES: O(c1cc(OC)ccc1CNC)C
(2)InChI: InChI=1/C10H15NO2/c1-11-7-8-4-5-9(12-2)6-10(8)13-3/h4-6,11H,7H2,1-3H3
(3)InChIKey: ULVUWTHGZHDWMW-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C10H15NO2/c1-11-7-8-4-5-9(12-2)6-10(8)13-3/h4-6,11H,7H2,1-3H3
(5)Std. InChIKey: ULVUWTHGZHDWMW-UHFFFAOYSA-N