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Home > Boronic Acids > 1350317-80-4
1350317-80-4 | {3-[(1-methoxypropan-2-yl)oxy]phenyl}boronic acid
CAS No: 1350317-80-4 Catalog No: AG01BDF9 MDL No:MFCD19654447
Product Description
Catalog Number:
AG01BDF9
Chemical Name:
{3-[(1-methoxypropan-2-yl)oxy]phenyl}boronic acid
CAS Number:
1350317-80-4
Molecular Formula:
C10H15BO4
Molecular Weight:
210.0347
MDL Number:
MFCD19654447
IUPAC Name:
[3-(1-methoxypropan-2-yloxy)phenyl]boronic acid
InChI:
InChI=1S/C10H15BO4/c1-8(7-14-2)15-10-5-3-4-9(6-10)11(12)13/h3-6,8,12-13H,7H2,1-2H3
InChI Key:
MLNIQZJIZKQIPX-UHFFFAOYSA-N
SMILES:
COCC(Oc1cccc(c1)B(O)O)C
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.036g/mol
Monoisotopic Mass:
210.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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