3,3,6,9,9-Pentamethyl-2,10-diazabicyclo[4.4.0]dec-1-ene - CAS 69340-58-5
Catalog: |
BB033783 |
Product Name: |
3,3,6,9,9-Pentamethyl-2,10-diazabicyclo[4.4.0]dec-1-ene |
CAS: |
69340-58-5 |
Synonyms: |
2,2,4a,7,7-pentamethyl-3,4,5,6-tetrahydro-1H-1,8-naphthyridine |
IUPAC Name: | 2,2,4a,7,7-pentamethyl-3,4,5,6-tetrahydro-1H-1,8-naphthyridine |
Description: | 3,3,6,9,9-Pentamethyl-2,10-diazabicyclo[4.4.0]dec-1-ene (CAS# 69340-58-5) is a useful research chemical compound. |
Molecular Weight: | 208.34 |
Molecular Formula: | C13H24N2 |
Canonical SMILES: | CC1(CCC2(CCC(N=C2N1)(C)C)C)C |
InChI: | InChI=1S/C13H24N2/c1-11(2)6-8-13(5)9-7-12(3,4)15-10(13)14-11/h6-9H2,1-5H3,(H,14,15) |
InChI Key: | OEOPGVPCZRQSMQ-UHFFFAOYSA-N |
Boiling Point: | 301.4 °C at 760 mmHg |
Density: | 0.924 g/mL at 20 °C (lit.) |
MDL: | MFCD03225609 |
LogP: | 2.74590 |
Publication Number | Title | Priority Date |
KR-102310667-B1 | Paint composition | 20191022 |
KR-20210047685-A | Paint composition | 20191022 |
EP-3772510-A1 | Process for preparing safinamide | 20190806 |
US-2021040033-A1 | Process for preparing safinamide | 20190806 |
EP-3761398-A1 | Solid polymer electrolyte | 20190704 |
Complexity: | 302 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.193948774 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.193948774 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 24.4 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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