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tert-Butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate

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Name

tert-Butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate

EINECS N/A
CAS No. 470478-90-1 Density 1.11 g/cm3
PSA 51.24000 LogP 3.04580
Solubility N/A Melting Point 157 °C
Formula C21H33BN2O4 Boiling Point 501.7 °C at 760 mmHg
Molecular Weight 388.315 Flash Point 257.2 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 470478-90-1 (4-(4-TERT-BUTOXYCARBONYLPIPERAZINYL)PHENYLBORONIC ACID, PINACOL ESTER) Hazard Symbols N/A
Synonyms

4-[4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)phenyl]piperazine-1-carboxylicacid tert-butyl ester;tert-Butyl4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate;

Article Data 13

tert-Butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate Specification

This chemical is called tert-Butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate, and its CAS registry number is 470478-90-1. With the molecular formula of C21H33BN2O4, its molecular weight is 388.31. Additionally, its product categories are Aryl; Boronic ester; Organoborons.

Other characteristics of the tert-Butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate can be summarised as followings: (1)#H bond acceptors: 6; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 51.24 Å2; (5)Index of Refraction: 1.536; (6)Molar Refractivity: 108.71 cm3; (7)Molar Volume: 348.4 cm3; (8)Polarizability: 43.09×10-24cm3; (9)Surface Tension: 41.7 dyne/cm; (10)Density: 1.11 g/cm3; (11)Flash Point: 257.2 °C; (12)Enthalpy of Vaporization: 77.05 kJ/mol; (13)Boiling Point: 501.7 °C at 760 mmHg; (14)Vapour Pressure: 3.4E-10 mmHg at 25°C.  

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC(C)(C)C)N3CCN(c2ccc(B1OC(C)(C)C(O1)(C)C)cc2)CC3
2.InChI: InChI=1/C21H33BN2O4/c1-19(2,3)26-18(25)24-14-12-23(13-15-24)17-10-8-16(9-11-17)22-27-20(4,5)21(6,7)28-22/h8-11H,12-15H2,1-7H3 3.InChIKey: ZMAVVXGWEHZLDW-UHFFFAOYAJ

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