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Home > Boronic Acids > 1704122-04-2
1704122-04-2 | N-isopropyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)acetamide
CAS No: 1704122-04-2 Catalog No: AG00ARSB MDL No:
Product Description
Catalog Number:
AG00ARSB
Chemical Name:
N-isopropyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)acetamide
CAS Number:
1704122-04-2
Molecular Formula:
C17H26BNO4
Molecular Weight:
319.2036
IUPAC Name:
N-propan-2-yl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]acetamide
InChI:
InChI=1S/C17H26BNO4/c1-12(2)19-15(20)11-21-14-9-7-13(8-10-14)18-22-16(3,4)17(5,6)23-18/h7-10,12H,11H2,1-6H3,(H,19,20)
InChI Key:
UKZJANAMCBGQII-UHFFFAOYSA-N
SMILES:
CC(NC(=O)COc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.195g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.208g/mol
Monoisotopic Mass:
319.195g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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