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160001-92-3

Basic Information
CAS No.: 160001-92-3
Name: 1-(4-Fluorophenyl)cyclopentanamine
Molecular Structure:
Molecular Structure of 160001-92-3 (1-(4-Fluorophenyl)cyclopentanamine)
Formula: C11H14FN
Molecular Weight: 179.23
Synonyms: 1-(4-FLUOROPHENYL)CYCLOPENTANAMINE;OTAVA-BB 1059651;UKRORGSYN-BB BBV-2159432
Density: 1.098 g/cm3
Boiling Point: 249.9 °C at 760 mmHg
Flash Point: 115.7 °C
PSA: 26.02000
LogP: 3.25400
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Specification

The Cyclopentanamine, 1-(4-fluorophenyl)- has the CAS registry number 160001-92-3. This chemical's molecular formula is C11H14FN and molecular weight is 179.23. What's more, its systematic name is 1-(4-fluorophenyl)cyclopentanamine. 

Physical properties of Cyclopentanamine, 1-(4-fluorophenyl)- are: (1)ACD/LogP: 2.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.11; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 2.1; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 26.02 Å2; (12)Index of Refraction: 1.537; (13)Molar Refractivity: 50.95 cm3; (14)Molar Volume: 163.1 cm3; (15)Polarizability: 20.2×10-24cm3; (16)Surface Tension: 41.8 dyne/cm; (17)Density: 1.098 g/cm3; (18)Flash Point: 115.7 °C; (19)Enthalpy of Vaporization: 48.71 kJ/mol; (20)Boiling Point: 249.9 °C at 760 mmHg; (21)Vapour Pressure: 0.0224 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: NC1(CCCC1)c2ccc(F)cc2
(2)InChI: InChI=1S/C11H14FN/c12-10-5-3-9(4-6-10)11(13)7-1-2-8-11/h3-6H,1-2,7-8,13H2
(3)InChIKey: DBSPGNRTDZEXGR-UHFFFAOYSA-N