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CAS No.: | 874290-93-4 |
---|---|
Name: | 4-[(DIMETHYLCARBAMOYL)AMINO]BENZENEBORONIC ACID, PINACOL ESTER 95%4-(3-DIMETHYLUREIDO)BENZENEBORONIC ACID, PINACOL ESTER |
Molecular Structure: | |
Formula: | C15H23BN2O3 |
Molecular Weight: | 290.17 |
Synonyms: | 4-(3-DIMETHYLUREIDO)BENZENEBORONIC ACID, PINACOL ESTER;4-(3-DIMETHYLUREIDO)PHENYLBORONIC ACID, PINACOL ESTER;4-[(DIMETHYLCARBAMOYL)AMINO]BENZENEBORONIC ACID, PINACOL ESTER;1,1-DIMETHYL-3-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]UREA;4-[(DIMETHYLCARBAMOYL)AMINO]BENZENEBORONIC ACID, PINACOL ESTER 95%4-(3-DIMETHYLUREIDO)BENZENEBORONIC ACID, PINACOL ESTER;4-[(Dimethylcarbamoyl)amino]benzeneboronic acid, pinacol ester 95%;4-(3,3-DiMethylureido)benzeneboronic acid pinacol ester, 95%;urea,N,N-diMethyl-N-(4-(4,4,5,5tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl) |
Density: | 1.09 g/cm3 |
Melting Point: | 151-155 °C |
Boiling Point: | 448.2 °C at 760 mmHg |
Flash Point: | 224.9 °C |
Hazard Symbols: | Xi |
PSA: | 50.80000 |
LogP: | 2.15230 |
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The Urea,N,N-dimethyl-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- is an organic compound with the formula C15H23BN2O3. The systematic name of this chemical is 1,1-dimethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea. With the CAS registry number 874290-93-4, it is also named as 4-(3-Dimethylureido)benzeneboronic acid, pinacol ester. The product's categories are Blocks; BoronicAcids.
Physical properties about Urea,N,N-dimethyl-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- are: (1)#H bond acceptors: 5; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 50.8 Å2; (5)Index of Refraction: 1.523; (6)Molar Refractivity: 80.99 cm3; (7)Molar Volume: 264.8 cm3; (8)Polarizability: 32.1×10-24cm3; (9)Surface Tension: 38.5 dyne/cm; (10)Density: 1.09 g/cm3; (11)Flash Point: 224.9 °C; (12)Enthalpy of Vaporization: 70.67 kJ/mol; (13)Boiling Point: 448.2 °C at 760 mmHg; (14)Vapour Pressure: 3.16E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: B1(OC(C(O1)(C)C)(C)C)c2ccc(cc2)NC(=O)N(C)C
(2)InChI: InChI=1/C15H23BN2O3/c1-14(2)15(3,4)21-16(20-14)11-7-9-12(10-8-11)17-13(19)18(5)6/h7-10H,1-6H3,(H,17,19)
(3)InChIKey: WFCXDAQSTGDHCJ-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C15H23BN2O3/c1-14(2)15(3,4)21-16(20-14)11-7-9-12(10-8-11)17-13(19)18(5)6/h7-10H,1-6H3,(H,17,19)
(5)Std. InChIKey: WFCXDAQSTGDHCJ-UHFFFAOYSA-N