The t-Butyl 1-piperazincarboxylate, with the cas registry number 143238-38-4, has the IUPAC name of tert-butyl piperazine-1-carboxylate.
The characteristics of this chemical are as follows: (1)ACD/LogP: 0.55; (2)ACD/LogD (pH 5.5): -1.2; (3)ACD/LogD (pH 7.4): 0.32; (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): 27.63; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 32.78; (12)Index of Refraction: 1.467; (13)Molar Refractivity: 50.17 cm3; (14)Molar Volume: 180.7 cm3; (15)Polarizability: 19.89 ×10-24 cm3; (16)Surface Tension: 34.2 dyne/cm; (17)Density: 1.03 g/cm3; (18)Flash Point: 109.8 °C; (19)Enthalpy of Vaporization: 49.56 kJ/mol; (20)Boiling Point: 258 °C at 760 mmHg; (21)Vapour Pressure: 0.0141 mmHg at 25°C.
While dealing with this chemical, you should be very cautious. This chemical may cause inflammation to the skin or other mucous membranes. You should take the following instructions. Wear suitable protective clothing, gloves and eye/face protection, and ig in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
Additionally, the following datas could be converted into the molecular structure:
(1)SMILES:O=C(OC(C)(C)C)N1CCNCC1
(2)InChI:InChI=1/C9H18N2O2/c1-9(2,3)13-8(12)11-6-4-10-5-7-11/h10H,4-7H2,1-3H3
(3)InChIKey:CWXPZXBSDSIRCS-UHFFFAOYAS
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