4,6-Dimethylpyrimidine-2-carbonitrile - CAS 22126-16-5
Catalog: |
BB017405 |
Product Name: |
4,6-Dimethylpyrimidine-2-carbonitrile |
CAS: |
22126-16-5 |
Synonyms: |
4,6-dimethyl-2-pyrimidinecarbonitrile; 4,6-dimethylpyrimidine-2-carbonitrile |
IUPAC Name: | 4,6-dimethylpyrimidine-2-carbonitrile |
Description: | 4,6-Dimethylpyrimidine-2-carbonitrile (CAS# 22126-16-5) is a useful research chemical. |
Molecular Weight: | 133.15 |
Molecular Formula: | C7H7N3 |
Canonical SMILES: | CC1=CC(=NC(=N1)C#N)C |
InChI: | InChI=1S/C7H7N3/c1-5-3-6(2)10-7(4-8)9-5/h3H,1-2H3 |
InChI Key: | UJUJKEOTNKJDHF-UHFFFAOYSA-N |
Boiling Point: | 279.4 ℃ at 760 mmHg |
Density: | 1.12 g/cm3 |
MDL: | MFCD00184767 |
LogP: | 0.96508 |
Publication Number | Title | Priority Date |
EP-3279998-A1 | Non-aqueous electrolyte and lithium secondary battery comprising same | 20150331 |
KR-101822064-B1 | Nonaqueous electrolyte and lithium secondary battery comprising the same | 20150331 |
KR-20160117370-A | Nonaqueous electrolyte and lithium secondary battery comprising the same | 20150331 |
US-10193182-B2 | Non-aqueous electrolyte and lithium secondary battery comprising same | 20150331 |
US-2018013168-A1 | Non-aqueous electrolyte and lithium secondary battery comprising same | 20150331 |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 133.063997236 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 133.063997236 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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