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Home > Boronic Acids > 1218790-42-1

1218790-42-1

1218790-42-1 | 2-Propenamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-

CAS No: 1218790-42-1 Catalog No: AG00168L MDL No:MFCD10700144

Product Description

Catalog Number:
AG00168L
Chemical Name:
2-Propenamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
CAS Number:
1218790-42-1
Molecular Formula:
C15H20BNO3
Molecular Weight:
273.1352
MDL Number:
MFCD10700144
IUPAC Name:
N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]prop-2-enamide
InChI:
InChI=1S/C15H20BNO3/c1-6-13(18)17-12-10-8-7-9-11(12)16-19-14(2,3)15(4,5)20-16/h6-10H,1H2,2-5H3,(H,17,18)
InChI Key:
RCMMYLJDIVTJPH-UHFFFAOYSA-N
SMILES:
C=CC(=O)Nc1ccccc1B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.154g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.139g/mol
Monoisotopic Mass:
273.154g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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