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Home > Boronic Acids > 852227-95-3

852227-95-3

852227-95-3 | 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine

CAS No: 852227-95-3 Catalog No: AG004Q90 MDL No:MFCD03412097

Product Description

Catalog Number:
AG004Q90
Chemical Name:
4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine
CAS Number:
852227-95-3
Molecular Formula:
C16H24BNO3
Molecular Weight:
289.1777
MDL Number:
MFCD03412097
IUPAC Name:
4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine
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
InChI Key:
NCJDKFFODGZRRL-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cccc(c1)N1CCOCC1

Properties

Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.185g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.182g/mol
Monoisotopic Mass:
289.185g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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