(5-Trimethylsilanylethynyl-pyridin-2-yl)-carbamic acid tert-butyl ester - CAS 470463-41-3
Catalog: |
BB026208 |
Product Name: |
(5-Trimethylsilanylethynyl-pyridin-2-yl)-carbamic acid tert-butyl ester |
CAS: |
470463-41-3 |
Synonyms: |
tert-butyl N-[5-(2-trimethylsilylethynyl)pyridin-2-yl]carbamate |
IUPAC Name: | tert-butyl N-[5-(2-trimethylsilylethynyl)pyridin-2-yl]carbamate |
Description: | (5-Trimethylsilanylethynyl-pyridin-2-yl)-carbamic acid tert-butyl ester (CAS# 470463-41-3) is a useful research chemical. |
Molecular Weight: | 290.43 |
Molecular Formula: | C15H22N2O2Si |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=NC=C(C=C1)C#C[Si](C)(C)C |
InChI: | InChI=1S/C15H22N2O2Si/c1-15(2,3)19-14(18)17-13-8-7-12(11-16-13)9-10-20(4,5)6/h7-8,11H,1-6H3,(H,16,17,18) |
InChI Key: | YGCSGXBHBYIJFY-UHFFFAOYSA-N |
Boiling Point: | 329.8 °C at 760 mmHg |
Melting Point: | 195-198 °C |
Purity: | 95 % |
Density: | 1.04 g/cm3 |
MDL: | MFCD04039865 |
LogP: | 3.73050 |
Publication Number | Title | Priority Date |
EP-2550255-B1 | Imaging agents for detecting neurological disorders | 20100323 |
CA-2756137-A1 | Imaging agents for detecting neurological disorders | 20090323 |
EP-2411057-A2 | Imaging agents for detecting neurological disorders | 20090323 |
EP-2411057-B1 | Imaging agents for detecting neurological disorders | 20090323 |
US-2010239496-A1 | Imaging agents for detecting neurological disorders | 20090323 |
Complexity: | 409 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 290.14505448 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 290.14505448 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 51.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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