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Home > Boronic Acids > 1228310-17-5
1228310-17-5 | 6-Isobutoxynaphthalene-2-boronic acid
CAS No: 1228310-17-5 Catalog No: AG009WUW MDL No:MFCD16260717
Product Description
Catalog Number:
AG009WUW
Chemical Name:
6-Isobutoxynaphthalene-2-boronic acid
CAS Number:
1228310-17-5
Molecular Formula:
C14H17BO3
Molecular Weight:
244.0940
MDL Number:
MFCD16260717
IUPAC Name:
[6-(2-methylpropoxy)naphthalen-2-yl]boronic acid
InChI:
InChI=1S/C14H17BO3/c1-10(2)9-18-14-6-4-11-7-13(15(16)17)5-3-12(11)8-14/h3-8,10,16-17H,9H2,1-2H3
InChI Key:
LRZCWHYVQRQCFU-UHFFFAOYSA-N
SMILES:
CC(COc1ccc2c(c1)ccc(c2)B(O)O)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.127g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.097g/mol
Monoisotopic Mass:
244.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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