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Home > Boronic Acids > 1883793-85-8
1883793-85-8 | 3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propyl acetate
CAS No: 1883793-85-8 Catalog No: AG00J0G8 MDL No:MFCD28976610
Product Description
Catalog Number:
AG00J0G8
Chemical Name:
3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propyl acetate
CAS Number:
1883793-85-8
Molecular Formula:
C17H25BO4
Molecular Weight:
304.1890
MDL Number:
MFCD28976610
IUPAC Name:
3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propyl acetate
InChI:
InChI=1S/C17H25BO4/c1-13(19)20-12-6-7-14-8-10-15(11-9-14)18-21-16(2,3)17(4,5)22-18/h8-11H,6-7,12H2,1-5H3
InChI Key:
FOAUGALPMXZXFV-UHFFFAOYSA-N
SMILES:
CC(=O)OCCCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.185g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.193g/mol
Monoisotopic Mass:
304.185g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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