2-(4-Phenoxyphenyl)pyrrolidine supplier

Name
2-(4-PHENOXYPHENYL)-PYRROLIDINE
EINECS
CAS No. 68548-73-2
Density 1.09 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₇NO
Boiling Point 359.9 °C at 760 mmHg
Molecular Weight 239.31
Flash Point 149 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(4-Phenoxyphenyl)-pyrrolidine;
PSA 21.26000
LogP 4.23220

2-(4-Phenoxyphenyl)pyrrolidine Specification

The CAS register number of Pyrrolidine,2-(4-phenoxyphenyl)- is 68548-73-2. The systematic name about this chemical is 2-(4-Phenoxyphenyl)pyrrolidine. The molecular formula about this chemical is C₁₆H₁₇NO and the molecular weight is 239.31.

Physical properties about Pyrrolidine,2-(4-phenoxyphenyl)- are: (1)ACD/LogP: 3.77; (2)ACD/LogD (pH 5.5): 0.68; (3)ACD/LogD (pH 7.4): 0.98; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2.16; (7)ACD/KOC (pH 7.4): 4.33; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 21.26 Å²; (12)Index of Refraction: 1.576; (13)Molar Refractivity: 72.68 cm³; (14)Molar Volume: 219.5 cm³; (15)Polarizability: 28.81x10^-24cm³; (16)Surface Tension: 41.5 dyne/cm; (17)Density: 1.09 g/cm³; (18)Flash Point: 149 °C; (19)Enthalpy of Vaporization: 60.55 kJ/mol; (20)Boiling Point: 359.9 °C at 760 mmHg; (21)Vapour Pressure: 2.31E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)Oc2ccc(cc2)C3CCCN3
(2)InChI: InChI=1/C16H17NO/c1-2-5-14(6-3-1)18-15-10-8-13(9-11-15)16-7-4-12-17-16/h1-3,5-6,8-11,16-17H,4,7,12H2
(3)InChIKey: GAYHPFQUCQLKKS-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C16H17NO/c1-2-5-14(6-3-1)18-15-10-8-13(9-11-15)16-7-4-12-17-16/h1-3,5-6,8-11,16-17H,4,7,12H2
(5)Std. InChIKey: GAYHPFQUCQLKKS-UHFFFAOYSA-N

Product Name

2-(4-PHENOXYPHENYL)-PYRROLIDINE

2-(4-Phenoxyphenyl)pyrrolidine Specification

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