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Home > Boronic Acids > 24341-76-2
24341-76-2 | Boronicacid, B-(2-methyl-3,5-dinitrophenyl)-
CAS No: 24341-76-2 Catalog No: AG007NS1 MDL No:MFCD00757434
Product Description
Catalog Number:
AG007NS1
Chemical Name:
Boronicacid, B-(2-methyl-3,5-dinitrophenyl)-
CAS Number:
24341-76-2
Molecular Formula:
C7H7BN2O6
Molecular Weight:
225.9513
MDL Number:
MFCD00757434
IUPAC Name:
(2-methyl-3,5-dinitrophenyl)boronic acid
InChI:
InChI=1S/C7H7BN2O6/c1-4-6(8(11)12)2-5(9(13)14)3-7(4)10(15)16/h2-3,11-12H,1H3
InChI Key:
ZESXGHPFWNSQQV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(B(O)O)c(c(c1)[N+](=O)[O-])C
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.04g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.951g/mol
Monoisotopic Mass:
226.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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