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| CAS No.: | 17283-14-6 |
|---|---|
| Name: | 3,4-DIMETHYLPHENETHYLAMINE |
| Molecular Structure: | |
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| Formula: | C10H15N |
| Molecular Weight: | 149.236 |
| Synonyms: | Phenethylamine,3,4-dimethyl- (8CI);2-(3,4-Dimethylphenyl)ethanamine;3,4-Dimethylphenethylamine; |
| Density: | 0.941 g/cm3 |
| Boiling Point: | 244.1 °C at 760 mmHg |
| Flash Point: | 101.4 °C |
| Hazard Symbols: |
 Xi, C
|
| Risk Codes: | 34 |
| Safety: | 26-36/37/39 |
| Transport Information: | 2735 |
| PSA: | 26.02000 |
| LogP: | 2.50490 |
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Specification
The CAS register number of Benzeneethanamine,3,4-dimethyl- is 17283-14-6. It also can be called as 3,4-Dimethylphenethylamine and the IUPAC name about this chemical is 2-(3,4-dimethylphenyl)ethanamine. The molecular formula about this chemical is C10H15N and the molecular weight is 149.23.
Physical properties about Benzeneethanamine,3,4-dimethyl- are: (1)ACD/LogP: 2.38; (2)#H bond acceptors: 1; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 3.24 Å2; (6)Index of Refraction: 1.53; (7)Molar Refractivity: 48.98 cm3; (8)Molar Volume: 158.4 cm3; (9)Polarizability: 19.42x10-24cm3; (10)Surface Tension: 36 dyne/cm; (11)Density: 0.941 g/cm3; (12)Flash Point: 101.4 °C; (13)Enthalpy of Vaporization: 48.11 kJ/mol; (14)Boiling Point: 244.1 °C at 760 mmHg; (15)Vapour Pressure: 0.031 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes and destroy living tissue on contact. It can cause burns. If you want to use it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: c1c(ccc(c1C)C)CCN
(2)InChI: InChI=1/C10H15N/c1-8-3-4-10(5-6-11)7-9(8)2/h3-4,7H,5-6,11H2,1-2H3
(3)InChIKey: IQXUVSNUSQIQCJ-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C10H15N/c1-8-3-4-10(5-6-11)7-9(8)2/h3-4,7H,5-6,11H2,1-2H3
(5)Std. InChIKey: IQXUVSNUSQIQCJ-UHFFFAOYSA-N