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Home > Boronic Acids > 1256355-71-1
1256355-71-1 | Boronic acid, B-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-
CAS No: 1256355-71-1 Catalog No: AG000O52 MDL No:MFCD12463471
Product Description
Catalog Number:
AG000O52
Chemical Name:
Boronic acid, B-[4-[(2,6-dichlorophenyl)methoxy]phenyl]-
CAS Number:
1256355-71-1
Molecular Formula:
C13H11BCl2O3
Molecular Weight:
296.9416
MDL Number:
MFCD12463471
IUPAC Name:
[4-[(2,6-dichlorophenyl)methoxy]phenyl]boronic acid
InChI:
InChI=1S/C13H11BCl2O3/c15-12-2-1-3-13(16)11(12)8-19-10-6-4-9(5-7-10)14(17)18/h1-7,17-18H,8H2
InChI Key:
LNWNXHQLHDTDAW-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1COc1ccc(cc1)B(O)O)Cl
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.018g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
296.938g/mol
Monoisotopic Mass:
296.018g/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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