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Home > Boronic Acids > 1256358-44-7
1256358-44-7 | Boronic acid, B-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-
CAS No: 1256358-44-7 Catalog No: AG000O4M MDL No:MFCD12634046
Product Description
Catalog Number:
AG000O4M
Chemical Name:
Boronic acid, B-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-
CAS Number:
1256358-44-7
Molecular Formula:
C13H11BCl2O3
Molecular Weight:
296.9416
MDL Number:
MFCD12634046
IUPAC Name:
[4-[(3,4-dichlorophenyl)methoxy]phenyl]boronic acid
InChI:
InChI=1S/C13H11BCl2O3/c15-12-6-1-9(7-13(12)16)8-19-11-4-2-10(3-5-11)14(17)18/h1-7,17-18H,8H2
InChI Key:
JVNVVJSQSXECFD-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)OCc1ccc(c(c1)Cl)Cl)O
Properties
Complexity:
273
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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