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422545-96-8

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Basic Information
CAS No.: 422545-96-8
Name: 2-Pyrrolidineethanamine,1-methyl-,(2R)-(9CI)
Article Data: 6
Molecular Structure:
Molecular Structure of 422545-96-8 (2-Pyrrolidineethanamine,1-methyl-,(2R)-(9CI))
Formula: C7H16N2
Molecular Weight: 128.217
Synonyms: 2-Pyrrolidineethanamine,1-methyl-,(2R)-(9CI);(2R)-1-Methyl-2-pyrrolidineethanamine;2-[(2R)-1-Methylpyrrolidin-2-yl]ethanaMine;(R)-2-(1-Methylpyrrolidin-2-yl)ethanaMine
Density: 0.909 g/cm3
Boiling Point: 152.7 °C at 760 mmHg
Flash Point: 65 °C
PSA: 29.26000
LogP: 1.06760
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Specification

The cas register number of (2R)-1-Methyl-2-pyrrolidineethanamine is 422545-96-8. It also can be called as 2-pyrrolidineethanamine, 1-methyl-, (2R)- and the Systematic name about this chemical is 2-[(2R)-1-methylpyrrolidin-2-yl]ethanamine.

Physical properties about (2R)-1-Methyl-2-pyrrolidineethanamine are: (1)ACD/LogP: 0.13; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 29.26Å2; (11)Index of Refraction: 1.473; (12)Molar Refractivity: 39.58 cm3; (13)Molar Volume: 141 cm3; (14)Surface Tension: 31.7 dyne/cm; (15)Density: 0.909 g/cm3; (16)Flash Point: 65 °C; (17)Enthalpy of Vaporization: 38.95 kJ/mol; (18)Boiling Point: 152.7 °C at 760 mmHg; (19)Vapour Pressure: 3.45 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1.SMILES: CN1CCC[C@@H]1CCN
2.InChI: InChI=1/C7H16N2/c1-9-6-2-3-7(9)4-5-8/h7H,2-6,8H2,1H3/t7-/m1/s1 
3.InChIKey: PNHGJPJOMCXSKN-SSDOTTSWBT
4.Std. InChI: InChI=1S/C7H16N2/c1-9-6-2-3-7(9)4-5-8/h7H,2-6,8H2,1H3/t7-/m1/s1