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Home > Boronic Acids > 428820-95-5
428820-95-5 | 2-(3,5-Dinitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 428820-95-5 Catalog No: AG00C0YW MDL No:MFCD11504965
Product Description
Catalog Number:
AG00C0YW
Chemical Name:
2-(3,5-Dinitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
428820-95-5
Molecular Formula:
C12H15BN2O6
Molecular Weight:
294.0683
MDL Number:
MFCD11504965
IUPAC Name:
2-(3,5-dinitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H15BN2O6/c1-11(2)12(3,4)21-13(20-11)8-5-9(14(16)17)7-10(6-8)15(18)19/h5-7H,1-4H3
InChI Key:
SFFDLKOCTJMCCJ-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.102g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.07g/mol
Monoisotopic Mass:
294.102g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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