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Home > Boronic Acids > 1221824-16-3
1221824-16-3 | 4-(2-Phenylethoxy)phenylboronic acid pinacol ester
CAS No: 1221824-16-3 Catalog No: AG00HGO2 MDL No:MFCD22493697
Product Description
Catalog Number:
AG00HGO2
Chemical Name:
4-(2-Phenylethoxy)phenylboronic acid pinacol ester
CAS Number:
1221824-16-3
Molecular Formula:
C20H25BO3
Molecular Weight:
324.2217
MDL Number:
MFCD22493697
IUPAC Name:
4,4,5,5-tetramethyl-2-[4-(2-phenylethoxy)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C20H25BO3/c1-19(2)20(3,4)24-21(23-19)17-10-12-18(13-11-17)22-15-14-16-8-6-5-7-9-16/h5-13H,14-15H2,1-4H3
InChI Key:
XNMMDTNMHZSXOR-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(cc1)OCCc1ccccc1
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.19g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.227g/mol
Monoisotopic Mass:
324.19g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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