IUPAC Name: Tert-butyl 2-(aminomethyl)piperidine-1-carboxylate
Molecular Formula: C11H22N2O2
Molecular Weight: 214.3 g/mol
Canonical SMILES: CC(C)(C)OC(=O)N1CCCCC1CN
InChI: InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-7-5-4-6-9(13)8-12/h9H,4-8,12H2,1-3H3
Mol File: 370069-31-1.mol
Product Categories: pharmacetical; Aminomethyl's; Pyrans, Piperidines & Piperazines; Piperidine; API intermediates; Pyrans, Piperidines & Piperazines; Building Blocks;Heterocyclic Building Blocks; Piperidines
XLogP3-AA: 1.1
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Exact Mass: 214.168128
MonoIsotopic Mass: 214.168128
Topological Polar Surface Area: 55.6
Heavy Atom Count: 15
Complexity: 223
Index of Refraction: 1.481
Molar Refractivity: 59.66 cm3
Molar Volume: 209.4 cm3
Polarizability: 23.65×10-24cm3
Surface Tension: 37 dyne/cm
Density: 1.023 g/cm3
Flash Point: 134.9 °C
Enthalpy of Vaporization: 53.94 kJ/mol
Boiling Point: 299.4 °C at 760 mmHg
Vapour Pressure of 2-(Aminomethyl)-1-Boc-piperidine (CAS NO.370069-31-1): 0.00119 mmHg at 25 °C
Hazard Codes: Xn,N
Risk Statements: 22-36/37/38-50
R22: Harmful if swallowed.
R36/37/38: Irritating to eyes, respiratory system and skin.
R50: Very toxic to aquatic organisms.
Safety Statements: 26-61
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S61: Avoid release to the environment. Refer to special instructions / safety data sheets.
HazardClass of 2-(Aminomethyl)-1-Boc-piperidine (CAS NO.370069-31-1): Irritant
2-(Aminomethyl)-1-Boc-piperidine (CAS NO.370069-31-1), its Synonyms are (1-Aminomethyl-propyl)-methyl-carboxylic acid tert-butyl ester ; 1-Boc-2-Aminomethyl-piperidine ; 2-Aminomethyl-piperidine-1-carboxylic acid tert-butyl ester ; 2-(Aminomethyl)-1-N-Boc-piperidine ; 1-N-Boc-2-(Aminomethyl)piperidine ; 1-Piperidinecarboxylic acid, 2-(Aminomethyl)-, 1,1-dimethyl ester ; N-Boc-2-Aminomethylpiperidine .
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