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1052714-63-2

1052714-63-2 | BENZYL 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YLCARBAMATE

CAS No: 1052714-63-2 Catalog No: AG009KPL MDL No:

Product Description

Catalog Number:
AG009KPL
Chemical Name:
BENZYL 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YLCARBAMATE
CAS Number:
1052714-63-2
Molecular Formula:
C19H23BN2O4
Molecular Weight:
354.2079
IUPAC Name:
benzyl N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]carbamate
InChI:
InChI=1S/C19H23BN2O4/c1-18(2)19(3,4)26-20(25-18)15-10-11-21-12-16(15)22-17(23)24-13-14-8-6-5-7-9-14/h5-12H,13H2,1-4H3,(H,22,23)
InChI Key:
VZJCIDBHCLRKFU-UHFFFAOYSA-N
SMILES:
O=C(Nc1cnccc1B1OC(C(O1)(C)C)(C)C)OCc1ccccc1

Properties

Complexity:
478  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.175g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
354.213g/mol
Monoisotopic Mass:
354.175g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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