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Home > Boronic Acids > 917757-44-9
917757-44-9 | 3-ACETOXY-4-METHOXYPHENYLBORONIC ACID, PINACOL ESTER
CAS No: 917757-44-9 Catalog No: AG00GSYG MDL No:MFCD06795645
Product Description
Catalog Number:
AG00GSYG
Chemical Name:
3-ACETOXY-4-METHOXYPHENYLBORONIC ACID, PINACOL ESTER
CAS Number:
917757-44-9
Molecular Formula:
C15H21BO5
Molecular Weight:
292.1352
MDL Number:
MFCD06795645
IUPAC Name:
[2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] acetate
InChI:
InChI=1S/C15H21BO5/c1-10(17)19-13-9-11(7-8-12(13)18-6)16-20-14(2,3)15(4,5)21-16/h7-9H,1-6H3
InChI Key:
XNQOYRPBJQKOGV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OC(=O)C)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.148g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.138g/mol
Monoisotopic Mass:
292.148g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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