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Home > Boronic Acids > 1256346-06-1
1256346-06-1 | Boronic acid, B-(3-methyl-5-propoxyphenyl)-
CAS No: 1256346-06-1 Catalog No: AG000O1N MDL No:MFCD16295067
Product Description
Catalog Number:
AG000O1N
Chemical Name:
Boronic acid, B-(3-methyl-5-propoxyphenyl)-
CAS Number:
1256346-06-1
Molecular Formula:
C10H15BO3
Molecular Weight:
194.0353
MDL Number:
MFCD16295067
IUPAC Name:
(3-methyl-5-propoxyphenyl)boronic acid
InChI:
InChI=1S/C10H15BO3/c1-3-4-14-10-6-8(2)5-9(7-10)11(12)13/h5-7,12-13H,3-4H2,1-2H3
InChI Key:
JVIXETMMBNQDES-UHFFFAOYSA-N
SMILES:
CCCOc1cc(C)cc(c1)B(O)O
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.037g/mol
Monoisotopic Mass:
194.111g/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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