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Home > Boronic Acids > 1073353-51-1
1073353-51-1 | 4-(2-Hydroxyethylcarbamoyl)phenylboronic acid, pinacol ester
CAS No: 1073353-51-1 Catalog No: AG007ENM MDL No:MFCD06795648
Product Description
Catalog Number:
AG007ENM
Chemical Name:
4-(2-Hydroxyethylcarbamoyl)phenylboronic acid, pinacol ester
CAS Number:
1073353-51-1
Molecular Formula:
C15H22BNO4
Molecular Weight:
291.1505
MDL Number:
MFCD06795648
IUPAC Name:
N-(2-hydroxyethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
InChI:
InChI=1S/C15H22BNO4/c1-14(2)15(3,4)21-16(20-14)12-7-5-11(6-8-12)13(19)17-9-10-18/h5-8,18H,9-10H2,1-4H3,(H,17,19)
InChI Key:
LOKVHTSZMDAUEL-UHFFFAOYSA-N
SMILES:
OCCNC(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.164g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.154g/mol
Monoisotopic Mass:
291.164g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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