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CAS No.: | 383127-22-8 |
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Name: | 2-(4-BROMO-PHENYL)-PYRROLIDINE |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C10H12BrN |
Molecular Weight: | 226.116 |
Synonyms: | 1-Bromo-4-(pyrrolidin-2-yl)benzene; |
Density: | 1.369 g/cm3 |
Boiling Point: | 287.2 °C at 760 mmHg |
Flash Point: | 127.5 °C |
PSA: | 12.03000 |
LogP: | 3.20240 |
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The Pyrrolidine,2-(4-bromophenyl)- is an organic compound with the formula C10H12BrN. The IUPAC name of this chemical is 2-(4-bromophenyl)pyrrolidine. With the CAS registry number 383127-22-8, it is also named as 2-(4-Bromo-phenyl)-pyrrolidine.
Physical properties about Pyrrolidine,2-(4-bromophenyl)- are: (1)ACD/LogP: 2.55; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 3.24 Å2; (6)Index of Refraction: 1.566; (7)Molar Refractivity: 53.92 cm3; (8)Molar Volume: 165.1 cm3; (9)Polarizability: 21.37×10-24cm3; (10)Surface Tension: 40.6 dyne/cm; (11)Density: 1.369 g/cm3; (12)Flash Point: 127.5 °C; (13)Enthalpy of Vaporization: 52.63 kJ/mol; (14)Boiling Point: 287.2 °C at 760 mmHg; (15)Vapour Pressure: 0.00252 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc(cc1)C2NCCC2
(2)InChI: InChI=1/C10H12BrN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2
(3)InChIKey: HIJZBROSVFKSCP-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C10H12BrN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2
(5)Std. InChIKey: HIJZBROSVFKSCP-UHFFFAOYSA-N