Basic information
- Name:
Urea,N-methoxy-N-methyl-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
- CAS No.:
874297-84-4
- Molecular Structure:
![Molecular Structure of 874297-84-4 (Urea,N-methoxy-N-methyl-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-)](http://www.lookchem.com/300w/2010/0626/874297-84-4.jpg)
- Formula:
- C15H23BN2O4
- Molecular Weight:
- 306.17
- Density:
- 1.13 g/cm3
- Hazard Symbols:
Xi
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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