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7359-58-2 | Tris(4-chlorophenyl); borate
CAS No: 7359-58-2 Catalog No: AG003V7K MDL No:MFCD00191614
Product Description
Catalog Number:
AG003V7K
Chemical Name:
Tris(4-chlorophenyl); borate
CAS Number:
7359-58-2
Molecular Formula:
C18H12BCl3O3
Molecular Weight:
393.4561
MDL Number:
MFCD00191614
IUPAC Name:
tris(4-chlorophenyl) borate
InChI:
InChI=1S/C18H12BCl3O3/c20-13-1-7-16(8-2-13)23-19(24-17-9-3-14(21)4-10-17)25-18-11-5-15(22)6-12-18/h1-12H
InChI Key:
JOAZIIBFQMIXJM-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)OB(Oc1ccc(cc1)Cl)Oc1ccc(cc1)Cl
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.995g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
393.451g/mol
Monoisotopic Mass:
391.995g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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