N-BOC-2-AMINOMETHYLPYRIDINE 97

The Carbamic acid,N-(2-pyridinylmethyl)-, 1,1-dimethylethyl ester, with the CAS registry number of 134807-28-6, is also known as N-Boc-2-(aminomethyl)pyridine. It belongs to the product categories of N-BOC; Heterocyclic Compounds. This chemical's molecular formula is C₁₁H₁₆N₂O₂ and molecular weight is 208.25694. What's more, its systematic name is tert-Butyl (pyridin-2-ylmethyl)carbamate.

Physical properties about the Carbamic acid,N-(2-pyridinylmethyl)-, 1,1-dimethylethyl ester are: (1)ACD/LogP: 1.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.36; (4)ACD/LogD (pH 7.4): 1.4; (5)ACD/BCF (pH 5.5): 6.23; (6)ACD/BCF (pH 7.4): 6.81; (7)ACD/KOC (pH 5.5): 125.66; (8)ACD/KOC (pH 7.4): 137.4; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 51.22 Å²; (13)Index of Refraction: 1.507; (14)Molar Refractivity: 57.76 cm³; (15)Molar Volume: 193.8 cm³; (16)Surface Tension: 39.1 dyne/cm; (17)Density: 1.074 g/cm³; (18)Flash Point: 153.4 °C; (19)Enthalpy of Vaporization: 57.25 kJ/mol; (20)Boiling Point: 330 °C at 760 mmHg; (21)Vapour Pressure: 0.000171 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1) SMILES: CC(C)(C)OC(=O)NCc1ccccn1
(2) InChI: InChI=1/C11H16N2O2/c1-11(2,3)15-10(14)13-8-9-6-4-5-7-12-9/h4-7H,8H2,1-3H3,(H,13,14)
(3) InChIKey: RKVWMMAKYQABGS-UHFFFAOYAW