3-(4-Chlorophenyl)-2-piperazinone - CAS 86147-28-6
Catalog: |
BB037836 |
Product Name: |
3-(4-Chlorophenyl)-2-piperazinone |
CAS: |
86147-28-6 |
Synonyms: |
3-(4-chlorophenyl)-2-piperazinone; 3-(4-chlorophenyl)piperazin-2-one |
IUPAC Name: | 3-(4-chlorophenyl)piperazin-2-one |
Description: | 3-(4-Chlorophenyl)-2-piperazinone (CAS# 86147-28-6) is a useful research chemical compound. |
Molecular Weight: | 210.66 |
Molecular Formula: | C10H11ClN2O |
Canonical SMILES: | C1CNC(=O)C(N1)C2=CC=C(C=C2)Cl |
InChI: | InChI=1S/C10H11ClN2O/c11-8-3-1-7(2-4-8)9-10(14)13-6-5-12-9/h1-4,9,12H,5-6H2,(H,13,14) |
InChI Key: | FGSVIJLVGJOUGJ-UHFFFAOYSA-N |
Appearance: | Solid |
LogP: | 1.70520 |
Publication Number | Title | Priority Date |
AU-2004223987-A1 | 2, 3, 6-trisubstituted-4-pyrimidone derivatives | 20030326 |
EA-009620-B1 | 2,3,6-triple-4-pyrimidone derivatives | 20030326 |
EP-1608630-A1 | 2, 3, 6-trisubstituted-4-pyrimidone derivatives | 20030326 |
EP-2305651-A1 | 2,3,6-trisubstituted-4-pyrimidone derivatives | 20030326 |
EP-2308854-A1 | 2,3,6-trisubstituted-4-pyrimidone derivatives | 20030326 |
Complexity: | 214 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.0559907 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.0559907 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 41.1 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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