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1841080-51-0 | 2-nitro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CAS No: 1841080-51-0 Catalog No: AG01CAC4 MDL No:MFCD11878182
Product Description
Catalog Number:
AG01CAC4
Chemical Name:
2-nitro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CAS Number:
1841080-51-0
Molecular Formula:
C11H15BN2O4
Molecular Weight:
250.0588
MDL Number:
MFCD11878182
IUPAC Name:
2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C11H15BN2O4/c1-10(2)11(3,4)18-12(17-10)8-5-6-13-9(7-8)14(15)16/h5-7H,1-4H3
InChI Key:
CCELCAOXPGETKP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1nccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.112g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.061g/mol
Monoisotopic Mass:
250.112g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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