2-Aminomethy-4-(4-fluorobenzyl)morpholine supplier

Name
4-[(4-Fluorophenyl)methyl]-2-morpholinemethanamine
EINECS
CAS No. 112914-13-3
Article Data7
CAS DataBase
Density 1.145 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₇FN₂O
Boiling Point 317.439 °C at 760 mmHg
Molecular Weight 224.278
Flash Point 145.782 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-[(4-Fluorophenyl)methyl]-2-morpholinemethanamine;
PSA 38.49000
LogP 1.62340

2-Aminomethy-4-(4-fluorobenzyl)morpholine Specification

The CAS register number of 2-Aminomethy-4-(4-fluorobenzyl)morpholine is 112914-13-3. It also can be called as 4-[(4-Fluorophenyl)methyl]-2-morpholinemethanamine and the systematic name about this chemical is 1-[4-(4-fluorobenzyl)morpholin-2-yl]methanamine. The molecular formula about this chemical is C₁₂H₁₇FN₂O and the molecular weight is 224.28.

Physical properties about 2-Aminomethy-4-(4-fluorobenzyl)morpholine are: (1)ACD/LogP: 0.91; (2)ACD/LogD (pH 5.5): -3; (3)ACD/LogD (pH 7.4): -2; (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): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 38.49Å²; (12)Index of Refraction: 1.535; (13)Molar Refractivity: 61.008 cm³; (14)Molar Volume: 195.814 cm³; (15)Polarizability: 24.185x10^-24cm³; (16)Surface Tension: 41.254 dyne/cm; (17)nthalpy of Vaporization: 55.885 kJ/mol; (18)Boiling Point: 317.439 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1)CN2CC(OCC2)CN
(2)InChI: InChI=1/C12H17FN2O/c13-11-3-1-10(2-4-11)8-15-5-6-16-12(7-14)9-15/h1-4,12H,5-9,14H2
(3)InChIKey: JHSPPBBJOLKJDH-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C12H17FN2O/c13-11-3-1-10(2-4-11)8-15-5-6-16-12(7-14)9-15/h1-4,12H,5-9,14H2
(5)Std. InChIKey: JHSPPBBJOLKJDH-UHFFFAOYSA-N

Product Name

4-[(4-Fluorophenyl)methyl]-2-morpholinemethanamine

2-Aminomethy-4-(4-fluorobenzyl)morpholine Specification

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