(4-Piperidinophenyl)methylamine supplier

Name
(4-PIPERIDINOPHENYL)METHYLAMINE
EINECS
CAS No. 214759-73-6
Article Data8
CAS DataBase
Density 1.047 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₈N₂
Boiling Point 342.8& #176;C at 760 mmHg
Molecular Weight 190.288
Flash Point 141.9 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 41
Molecular Structure
Hazard Symbols C
Synonyms 4-(Piperidino)benzylamine;(4-Piperidinophenyl)methylamine;
PSA 29.26000
LogP 2.90090

(4-Piperidinophenyl)methylamine Specification

The IUPAC name of (4-Piperidinophenyl)methylamine is (4-piperidin-1-ylphenyl)methanamine. With the CAS registry number 214759-73-6, it is also named as 4-(Piperidin-1yl)benzylamine. In addition, its molecular formula is C₁₂H₁₈N₂ and its molecular weight is 190.28.

The other characteristics of (4-Piperidinophenyl)methylamine can be summarized as: (1)ACD/LogP: 1.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.27; (4)ACD/LogD (pH 7.4): -0.92; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)H bond acceptors: 2; (10)H bond donors: 2; (11)Freely Rotating Bonds: 3; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.568; (14)Molar Refractivity: 59.52 cm³; (15)Molar Volume: 181.6 cm³; (16)Polarizability: 23.59×10^-24cm³; (17)Surface Tension: 44.3 dyne/cm; (18)Density: 1.047 g/cm³; (19)Flash Point: 141.9 °C; (20)Enthalpy of Vaporization: 58.66 kJ/mol; (21)Boiling Point: 342.8 °C at 760 mmHg; (22)Vapour Pressure: 7.35E-05 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:c1cc(ccc1CN)N2CCCCC2
(2)InChI:InChI=1/C12H18N2/c13-10-11-4-6-12(7-5-11)14-8-2-1-3-9-14/h4-7H,1-3,8-10,13H2
(3)InChIKey:WROBJEHXMLQDQP-UHFFFAOYAH
(4)Std. InChI:InChI=1S/C12H18N2/c13-10-11-4-6-12(7-5-11)14-8-2-1-3-9-14/h4-7H,1-3,8-10,13H2
(5)Std. InChIKey:WROBJEHXMLQDQP-UHFFFAOYSA-N

Product Name

(4-PIPERIDINOPHENYL)METHYLAMINE

(4-Piperidinophenyl)methylamine Specification

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