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Home > Boronic Acids > 1363386-57-5
1363386-57-5 | 2-(6-Isobutoxy-naphthalen-2-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
CAS No: 1363386-57-5 Catalog No: AG00HULE MDL No:MFCD26142761
Product Description
Catalog Number:
AG00HULE
Chemical Name:
2-(6-Isobutoxy-naphthalen-2-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
CAS Number:
1363386-57-5
Molecular Formula:
C20H27BO3
Molecular Weight:
326.2376
MDL Number:
MFCD26142761
IUPAC Name:
4,4,5,5-tetramethyl-2-[6-(2-methylpropoxy)naphthalen-2-yl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C20H27BO3/c1-14(2)13-22-18-10-8-15-11-17(9-7-16(15)12-18)21-23-19(3,4)20(5,6)24-21/h7-12,14H,13H2,1-6H3
InChI Key:
UEDXKTPSWIFJGL-UHFFFAOYSA-N
SMILES:
CC(COc1ccc2c(c1)ccc(c2)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.205g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.243g/mol
Monoisotopic Mass:
326.205g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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