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874297-84-4

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Basic Information
CAS No.: 874297-84-4
Name: 1-METHOXY-1-METHYL-3-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]UREA
Molecular Structure:
Molecular Structure of 874297-84-4 (1-METHOXY-1-METHYL-3-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]UREA)
Formula: C15H23BN2O4
Molecular Weight: 306.17
Synonyms: 1-METHOXY-1-METHYL-3-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]UREA;4-(3-METHOXY-3-METHYLUREIDO)PHENYLBORONIC ACID, PINACOL ESTER;4-(3-Methoxy-3-methylureido)benzeneboronic acid, pinacol ester;4-{[Methoxy(methyl)carbamoyl]amino}benzeneboronic acid, pinacol ester;4-{[Methoxy(methyl)carbamoyl]amino}benzeneboronic acid, pinacol ester 98%;urea,N-Methoxy-n-Methyl-N-(4-4,4,5,5-tetraMethy(1,3,2-dioxabor0lan-2-yl)phenyl
Density: 1.13 g/cm3
Melting Point: 167-170℃
Hazard Symbols: IrritantXi
PSA: 60.03000
LogP: 2.08390
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Specification

The Urea,N-methoxy-N-methyl-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- is an organic compound with the formula C15H23BN2O4. The systematic name of this chemical is 1-methoxy-1-methyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea. With the CAS registry number 874297-84-4, it is also named as 4-(3-Methoxy-3-methylureido)benzeneboronic acid, pinacol ester. The product's categories are Blocks; BoronicAcids.

Physical properties about Urea,N-methoxy-N-methyl-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- are: (1)#H bond acceptors: 6; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 60.03 Å2; (5)Index of Refraction: 1.522; (6)Molar Refractivity: 82.73 cm3; (7)Molar Volume: 270.9 cm3; (8)Polarizability: 32.79×10-24cm3; (9)Surface Tension: 39.7 dyne/cm; (10)Density: 1.13 g/cm3.

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)OC
(2)InChI: InChI=1/C15H23BN2O4/c1-14(2)15(3,4)22-16(21-14)11-7-9-12(10-8-11)17-13(19)18(5)20-6/h7-10H,1-6H3,(H,17,19)
(3)InChIKey: VVAGLFFLRWVFLI-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C15H23BN2O4/c1-14(2)15(3,4)22-16(21-14)11-7-9-12(10-8-11)17-13(19)18(5)20-6/h7-10H,1-6H3,(H,17,19)
(5)Std. InChIKey: VVAGLFFLRWVFLI-UHFFFAOYSA-N