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Home > Boronic Acids > 214360-73-3
214360-73-3 | 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CAS No: 214360-73-3 Catalog No: AG0033SW MDL No:MFCD02093721
Product Description
Catalog Number:
AG0033SW
Chemical Name:
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CAS Number:
214360-73-3
Molecular Formula:
C12H18BNO2
Molecular Weight:
219.0878
MDL Number:
MFCD02093721
IUPAC Name:
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
InChI:
InChI=1S/C12H18BNO2/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8H,14H2,1-4H3
InChI Key:
ZANPJXNYBVVNSD-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(cc1)N
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.143g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.091g/mol
Monoisotopic Mass:
219.143g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Palladium-mediated intracellular chemistry. | Nature chemistry 20110301 |
| ATP-competitive inhibitors of the mitotic kinesin KSP that function via an allosteric mechanism. | Nature chemical biology 20071101 |
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