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Home > Boronic Acids > 1072951-89-3
1072951-89-3 | (3-((4-Methoxybenzyl)oxy)phenyl)boronic acid
CAS No: 1072951-89-3 Catalog No: AG0084WG MDL No:MFCD09038416
Product Description
Catalog Number:
AG0084WG
Chemical Name:
(3-((4-Methoxybenzyl)oxy)phenyl)boronic acid
CAS Number:
1072951-89-3
Molecular Formula:
C14H15BO4
Molecular Weight:
258.0775
MDL Number:
MFCD09038416
IUPAC Name:
[3-[(4-methoxyphenyl)methoxy]phenyl]boronic acid
InChI:
InChI=1S/C14H15BO4/c1-18-13-7-5-11(6-8-13)10-19-14-4-2-3-12(9-14)15(16)17/h2-9,16-17H,10H2,1H3
InChI Key:
BBNOCVPPEAVHKK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COc1cccc(c1)B(O)O
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.08g/mol
Monoisotopic Mass:
258.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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