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3-(2-Phenylethyl)pyrrolidine (613676-70-3)

Identification
Name:3-(2-Phenylethyl)pyrrolidine
Synonyms:3-(2-PHENYLETHYL)PYRROLIDINE;3-PHENETHYL-PYRROLIDINE
CAS:613676-70-3
Molecular Formula: C12H17N
Molecular Weight: 175.27
InChI: InChI=1/C12H17N/c1-2-4-11(5-3-1)6-7-12-8-9-13-10-12/h1-5,12-13H,6-10H2
Molecular Structure: (C12H17N) 3-(2-PHENYLETHYL)PYRROLIDINE;3-PHENETHYL-PYRROLIDINE
Properties
Density:0.957 g/cm3
Refractive index:1.519
Specification:

 The cas register number of 3-(2-Phenylethyl)pyrrolidine is 613676-70-3. The IUPAC Name about this chemical is 3-phenethylpyrrolidine. This chemical is irritant, so when you using it, please be more careful.

Physical properties about 3-(2-Phenylethyl)pyrrolidine are: (1)ACD/LogP: 2.84; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 3.24Å2; (6)Index of Refraction: 1.519; (7)Molar Refractivity: 55.6 cm3; (8)Molar Volume: 183 cm3; (9)Polarizability: 22.04x10-24cm3; (10)Surface Tension: 36.3 dyne/cm; (11)Flash Point: 118.3 °C; (12)Enthalpy of Vaporization: 50.85 kJ/mol; (13)Boiling Point: 270.3 °C at 760 mmHg; (14)Vapour Pressure: 0.00688 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cccc1)CCC2CCNC2
(2)InChI: InChI=1/C12H17N/c1-2-4-11(5-3-1)6-7-12-8-9-13-10-12/h1-5,12-13H,6-10H2
(3)InChIKey: GLZRMVTXAKDQMC-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C12H17N/c1-2-4-11(5-3-1)6-7-12-8-9-13-10-12/h1-5,12-13H,6-10H2
(5)Std. InChIKey: GLZRMVTXAKDQMC-UHFFFAOYSA-N

Safety Data
 

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