Morpholine,4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- supplier

Name
3-MORPHOLINOPHENYLBORONIC ACID PINACOL ESTER
EINECS
CAS No. 852227-95-3
Article Data6
CAS DataBase
Density 1.096 g/cm³
Solubility
Melting Point 235 °C
Formula C₁₆H₂₄BNO₃
Boiling Point 431.51 °C at 760 mmHg
Molecular Weight 289.182
Flash Point 214.77 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine;AC1N5BYR;MolPort-000-141-270;CC33839;CID4192663;EN000541;
PSA 30.93000
LogP 1.88740

Morpholine,4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- Specification

The Morpholine,4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- with CAS registry number of 852227-95-3 is also known as CID4192663. The IUPAC name is 4-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine. It belongs to product categories of Boronic Acid; Aryl; Boronic ester; Organoborons. In addition, the formula is C₁₆H₂₄BNO₃ and the molecular weight is 289.18.

Physical properties about Morpholine,4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- are: (1)#H bond acceptors: 4; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 30.93Å²; (5)Index of Refraction: 1.53; (6)Molar Refractivity: 81.557 cm³; (7)Molar Volume: 263.85 cm³; (8)Polarizability: 32.332×10^-24cm³; (9)Surface Tension: 38.574 dyne/cm; (10)Density: 1.096 g/cm³; (11)Flash Point: 214.77 °C; (12)Enthalpy of Vaporization: 68.714 kJ/mol; (13)Boiling Point: 431.51 °C at 760 mmHg; (14)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: B1(OC(C(O1)(C)C)(C)C)c2cccc(c2)N3CCOCC3
2. InChI: InChI=1/C16H24BNO3/c1-15(2)16(3,4)21-17(20-15)13-6-5-7-14(12-13)18-8-10-19-11-9-18/h5-7,12H,8-11H2,1-4H3
3. InChIKey: NCJDKFFODGZRRL-UHFFFAOYAX
4. Std. InChI: InChI=1S/C16H24BNO3/c1-15(2)16(3,4)21-17(20-15)13-6-5-7-14(12-13)18-8-10-19-11-9-18/h5-7,12H,8-11H2,1-4H3
5. Std. InChIKey: NCJDKFFODGZRRL-UHFFFAOYSA-N

Product Name

3-MORPHOLINOPHENYLBORONIC ACID PINACOL ESTER

Morpholine,4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- Specification

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