related chemical

CAS 100570-24-9 chemical formula,CAS 100570-24-9 MSDS,CAS 100570-24-9 chemical properties

CAS Number 100570-24-9
chem name (R)-1-(3,4-Dimethoxyphenyl)ethylamine
formula C10H15NO2
structure
synonyms Benzenemethanamine,3,4-dimethoxy-a-methyl-,(R)-;(R)-1-(3,4-Dimethoxyphenyl)ethylamine;
properties

CAS Number 100570-24-9 properties (MSDS)

Specification

This chemical is called (R)-1-(3,4-Dimethoxyphenyl)ethylamine, and it can also be named as benzenemethanamine, 3,4-dimethoxy-α-methyl-, (alphaR)-. With the molecular formula of C10H15NO2, its molecular weight is 181.23. The CAS registry number of this chemical is 100570-24-9, and its product category is API Intermediates.

Other characteristics of the (R)-1-(3,4-Dimethoxyphenyl)ethylamine can be summarised as followings: (1)ACD/LogP: 1.17; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 21.7 Å2; (7)Index of Refraction: 1.515; (8)Molar Refractivity: 52.69 cm3; (9)Molar Volume: 174.6 cm3; (10)Polarizability: 20.89×10-24cm3; (11)Surface Tension: 35 dyne/cm; (12)Density: 1.037 g/cm3; (13)Flash Point: 128.2 °C; (14)Enthalpy of Vaporization: 51.03 kJ/mol; (15)Boiling Point: 272 °C at 760 mmHg; (16)Vapour Pressure: 0.00623 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O(c1ccc(cc1OC)[C@H](N)C)C
2.InChI: InChI=1/C10H15NO2/c1-7(11)8-4-5-9(12-2)10(6-8)13-3/h4-7H,11H2,1-3H3/t7-/m1/s1
3.InChIKey: OEPFPKVWOOSTBV-SSDOTTSWBI