1-(2-Naphthyl)cyclopentanecarbonitrile - CAS 1239681-53-8
Catalog: |
BB005770 |
Product Name: |
1-(2-Naphthyl)cyclopentanecarbonitrile |
CAS: |
1239681-53-8 |
Synonyms: |
1-(2-naphthalenyl)-1-cyclopentanecarbonitrile; 1-naphthalen-2-ylcyclopentane-1-carbonitrile |
IUPAC Name: | 1-naphthalen-2-ylcyclopentane-1-carbonitrile |
Description: | 1-(2-Naphthyl)cyclopentanecarbonitrile (CAS# 1239681-53-8 ) is a useful research chemical. |
Molecular Weight: | 221.30 |
Molecular Formula: | C16H15N |
Canonical SMILES: | C1CCC(C1)(C#N)C2=CC3=CC=CC=C3C=C2 |
InChI: | InChI=1S/C16H15N/c17-12-16(9-3-4-10-16)15-8-7-13-5-1-2-6-14(13)11-15/h1-2,5-8,11H,3-4,9-10H2 |
InChI Key: | ROCIEOUYIMZFGP-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
AU-2014204889-A1 | Pyrimidone derivatives and their use in the treatment, amelioration or prevention of a viral disease | 20130108 |
CA-2894642-A1 | Pyrimidone derivatives and their use in the treatment, amelioration or prevention of a viral disease | 20130108 |
EP-2943495-A1 | Pyrimidone derivatives and their use in the treatment, amelioration or prevention of a viral disease | 20130108 |
EP-2943495-B1 | Pyrimidone derivatives and their use in the treatment, amelioration or prevention of a viral disease | 20130108 |
JP-2016518305-A | Pyrimidone derivatives and their use in the treatment, amelioration or prevention of viral diseases | 20130108 |
Complexity: | 318 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.120449483 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.120449483 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 23.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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