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Home > Boronic Acids > 1073353-99-7
1073353-99-7 | 5-Chloro-2-nitrophenylboronic acid, pinacol ester
CAS No: 1073353-99-7 Catalog No: AG007ENK MDL No:MFCD11053894
Product Description
Catalog Number:
AG007ENK
Chemical Name:
5-Chloro-2-nitrophenylboronic acid, pinacol ester
CAS Number:
1073353-99-7
Molecular Formula:
C12H15BClNO4
Molecular Weight:
283.5158
MDL Number:
MFCD11053894
IUPAC Name:
2-(5-chloro-2-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H15BClNO4/c1-11(2)12(3,4)19-13(18-11)9-7-8(14)5-6-10(9)15(16)17/h5-7H,1-4H3
InChI Key:
OGXVNFUFZOAUNA-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cc(Cl)ccc1[N+](=O)[O-]
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.515g/mol
Monoisotopic Mass:
283.078g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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