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Home > Boronic Acids > 942069-95-6
942069-95-6 | 4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane
CAS No: 942069-95-6 Catalog No: AG003KDA MDL No:MFCD11504973
Product Description
Catalog Number:
AG003KDA
Chemical Name:
4,4,5,5-Tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane
CAS Number:
942069-95-6
Molecular Formula:
C12H14BCl3O2
Molecular Weight:
307.4084
MDL Number:
MFCD11504973
IUPAC Name:
4,4,5,5-tetramethyl-2-(3,4,5-trichlorophenyl)-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H14BCl3O2/c1-11(2)12(3,4)18-13(17-11)7-5-8(14)10(16)9(15)6-7/h5-6H,1-4H3
InChI Key:
OTPVENHYVDCFAO-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cc(Cl)c(c(c1)Cl)Cl
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.015g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.402g/mol
Monoisotopic Mass:
306.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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