4-Amino-1-benzyl-3-methylpiperidine supplier

Name
4-Amino-1-benzyl-3-methylpiperidine
EINECS
CAS No. 82378-86-7
Article Data3
CAS DataBase
Density 1.005 g/cm³
Solubility
Melting Point
Formula C₁₃H₂₀N₂
Boiling Point 291.136 °C at 760 mmHg
Molecular Weight 204.315
Flash Point 120.985 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Amino-1-benzyl-3-methylpiperidine;4-PiperidinaMine, 3-Methyl-1-(phenylMethyl)-;1-benzyl-3-Methylpiperidin-4-aMine;1-Benzyl-3-methylpiperidin-4-ylamine
PSA 29.26000
LogP 2.49390

4-Amino-1-benzyl-3-methylpiperidine Specification

The 4-Amino-1-benzyl-3-methylpiperidine, with the CAS registry number 82378-86-7, has the systematic name 1-benzyl-3-methylpiperidin-4-amine. Its molecular formula is C₁₃H₂₀N₂ and its molecular weight is 204.3113. Additionally, its product category is Pharmacetical.

Other characteristics of the 4-Amino-1-benzyl-3-methylpiperidine can be summarised as followings: (1)ACD/LogP: 3.00; (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: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 29.26 Å²; (11)Index of Refraction: 1.542; (12)Molar Refractivity: 64.053 cm³; (13)Molar Volume: 203.381 cm³; (14)Polarizability: 25.392×10^-24cm³; (15)Surface Tension: 38.496 dyne/cm; (16)Density: 1.005 g/cm³; (17)Flash Point: 120.985 °C; (18)Enthalpy of Vaporization: 53.055 kJ/mol; (19)Boiling Point: 291.136 °C at 760 mmHg; (20)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: NC2CCN(Cc1ccccc1)CC2C
2.InChI: InChI=1/C13H20N2/c1-11-9-15(8-7-13(11)14)10-12-5-3-2-4-6-12/h2-6,11,13H,7-10,14H2,1H3
3.InChIKey: MGTFEKWKCLDVNN-UHFFFAOYAU

Product Name

4-Amino-1-benzyl-3-methylpiperidine

4-Amino-1-benzyl-3-methylpiperidine Specification

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