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tert-Butyl 2-(1-methyl-1H-pyrazol-4-yl)ethylcarbamate

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tert-Butyl 2-(1-methyl-1H-pyrazol-4-yl)ethylcarbamate

EINECS 604-604-1
CAS No. 1188264-99-4 Density 1.08 g/cm3
PSA 59.64000 LogP 1.69170
Solubility N/A Melting Point N/A
Formula C11H19N3O2 Boiling Point 365.5 °C at 760 mmHg
Molecular Weight 225.29 Flash Point 174.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1188264-99-4 (tert-Butyl 2-(1-methyl-1H-pyrazol-4-yl)ethylcarbamate) Hazard Symbols N/A

tert-Butyl N-[2-(1-methylpyrazol-4-yl)ethyl]carbamate;


tert-Butyl 2-(1-methyl-1H-pyrazol-4-yl)ethylcarbamate Specification

The tert-Butyl 2-(1-methyl-1H-pyrazol-4-yl)ethylcarbamate has the CAS registry number 1188264-99-4. This chemical's molecular formula is C11H19N3O2 and molecular weight is 225.29. What's more, its systematic name is tert-butyl N-[2-(1-methylpyrazol-4-yl)ethyl]carbamate.

Physical properties of tert-Butyl 2-(1-methyl-1H-pyrazol-4-yl)ethylcarbamate are: (1)ACD/LogP: 1.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.26; (4)ACD/LogD (pH 7.4): 1.26; (5)ACD/BCF (pH 5.5): 5.31; (6)ACD/BCF (pH 7.4): 5.31; (7)ACD/KOC (pH 5.5): 114.89; (8)ACD/KOC (pH 7.4): 115; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 56.15 Å2; (13)Index of Refraction: 1.518; (14)Molar Refractivity: 62.78 cm3; (15)Molar Volume: 207 cm3; (16)Polarizability: 24.89×10-24cm3; (17)Surface Tension: 36 dyne/cm; (18)Density: 1.08 g/cm3; (19)Flash Point: 174.8 °C; (20)Enthalpy of Vaporization: 61.18 kJ/mol; (21)Boiling Point: 365.5 °C at 760 mmHg; (22)Vapour Pressure: 1.57E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)NCCc1cnn(c1)C
(2)Std. InChI: InChI=1S/C11H19N3O2/c1-11(2,3)16-10(15)12-6-5-9-7-13-14(4)8-9/h7-8H,5-6H2,1-4H3,(H,12,15)

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