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Home > Boronic Acids > 2003223-29-6
2003223-29-6 | 4,4,5,5-Tetramethyl-2-[(3-nitrophenyl)methyl]-1,3,2-dioxaborolane
CAS No: 2003223-29-6 Catalog No: AG00I3Q9 MDL No:MFCD27936322
Product Description
Catalog Number:
AG00I3Q9
Chemical Name:
4,4,5,5-Tetramethyl-2-[(3-nitrophenyl)methyl]-1,3,2-dioxaborolane
CAS Number:
2003223-29-6
Molecular Formula:
C13H18BNO4
Molecular Weight:
263.0973
MDL Number:
MFCD27936322
IUPAC Name:
4,4,5,5-tetramethyl-2-[(3-nitrophenyl)methyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BNO4/c1-12(2)13(3,4)19-14(18-12)9-10-6-5-7-11(8-10)15(16)17/h5-8H,9H2,1-4H3
InChI Key:
GRLYMFHDBKFELJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)CB1OC(C(O1)(C)C)(C)C
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.133g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.1g/mol
Monoisotopic Mass:
263.133g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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