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Home > Boronic Acids > 1426804-80-9
1426804-80-9 | 2-(2-Chloro-4-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1426804-80-9 Catalog No: AG009WU2 MDL No:MFCD20529521
Product Description
Catalog Number:
AG009WU2
Chemical Name:
2-(2-Chloro-4-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1426804-80-9
Molecular Formula:
C12H15BClNO4
Molecular Weight:
283.5158
MDL Number:
MFCD20529521
IUPAC Name:
2-(2-chloro-4-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H15BClNO4/c1-11(2)12(3,4)19-13(18-11)9-6-5-8(15(16)17)7-10(9)14/h5-7H,1-4H3
InChI Key:
AYPQIFIELRRUTA-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1B1OC(C(O1)(C)C)(C)C)[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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