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Home > Boronic Acids > 1521255-61-7
1521255-61-7 | Ethyl 1-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropane-1-carboxylate
CAS No: 1521255-61-7 Catalog No: AG01CCRN MDL No:
Product Description
Catalog Number:
AG01CCRN
Chemical Name:
Ethyl 1-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropane-1-carboxylate
CAS Number:
1521255-61-7
Molecular Formula:
C18H25BO4
Molecular Weight:
316.1997
IUPAC Name:
ethyl 1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropane-1-carboxylate
InChI:
InChI=1S/C18H25BO4/c1-6-21-15(20)18(10-11-18)13-8-7-9-14(12-13)19-22-16(2,3)17(4,5)23-19/h7-9,12H,6,10-11H2,1-5H3
InChI Key:
LCGONBLZRDYLOM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CC1)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.185g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.204g/mol
Monoisotopic Mass:
316.185g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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