Pyrrolidine, 2-[(4-fluorophenyl)methyl]- supplier

Name
2-(4-FLUORO-BENZYL)-PYRROLIDINE
EINECS
CAS No. 350017-04-8
Density 1.072 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₄FN
Boiling Point 253.003 °C at 760 mmHg
Molecular Weight 179.237
Flash Point 106.813 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-[(4-Fluorophenyl)methyl]pyrrolidine;
PSA 12.03000
LogP 2.44900

Pyrrolidine, 2-[(4-fluorophenyl)methyl]- Specification

The Pyrrolidine, 2-[(4-fluorophenyl)methyl]-, with the CAS registry number 350017-04-8, is also known as 2-(4-Fluoro-benzyl)-pyrrolidine. This chemical's molecular formula is C₁₁H₁₄FN and molecular weight is 179.23. What's more, its IUPAC name is 2-[(4-Fluorophenyl)methyl]pyrrolidine.

Physical properties about Pyrrolidine, 2-[(4-fluorophenyl)methyl]- are: (1)ACD/LogP: 2.33; (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: 1; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 12.03 Å²; (11)Index of Refraction: 1.521; (12)Molar Refractivity: 50.955 cm³; (13)Molar Volume: 167.26 cm³; (14)Polarizability: 20.2×10^-24 cm³; (15)Surface Tension: 36.525 dyne/cm; (16)Density: 1.072 g/cm³; (17)Flash Point: 106.813 °C; (18)Enthalpy of Vaporization: 49.037 kJ/mol; (19)Boiling Point: 253.003 °C at 760 mmHg; (20)Vapour Pressure: 0.019 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(ccc1CC2CCCN2)F
(2) InChI: InChI=1/C11H14FN/c12-10-5-3-9(4-6-10)8-11-2-1-7-13-11/h3-6,11,13H,1-2,7-8H2
(3) InChIKey: VVKUNLLPKQCGHF-UHFFFAOYAB

Product Name

2-(4-FLUORO-BENZYL)-PYRROLIDINE

Pyrrolidine, 2-[(4-fluorophenyl)methyl]- Specification

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