1-(4-Nitrophenyl)piperazin-2-one - CAS 867166-73-2
Catalog: |
BB038044 |
Product Name: |
1-(4-Nitrophenyl)piperazin-2-one |
CAS: |
867166-73-2 |
Synonyms: |
1-(4-nitrophenyl)-2-piperazinone; 1-(4-nitrophenyl)piperazin-2-one |
IUPAC Name: | 1-(4-nitrophenyl)piperazin-2-one |
Description: | 1-(4-Nitrophenyl)piperazin-2-one (CAS# 867166-73-2) is a useful research chemical. |
Molecular Weight: | 221.21 |
Molecular Formula: | C10H11N3O3 |
Canonical SMILES: | C1CN(C(=O)CN1)C2=CC=C(C=C2)[N+](=O)[O-] |
InChI: | InChI=1S/C10H11N3O3/c14-10-7-11-5-6-12(10)8-1-3-9(4-2-8)13(15)16/h1-4,11H,5-7H2 |
InChI Key: | TXHGONHNTRRRNA-UHFFFAOYSA-N |
LogP: | 1.44800 |
Publication Number | Title | Priority Date |
CN-110818641-A | Pyridazine-3-formamide compound, preparation method and application thereof in medicine and pharmacology | 20180807 |
EP-1907385-A2 | Compounds | 20050726 |
EP-1907385-A4 | LINKS | 20050726 |
JP-2009502919-A | Compound | 20050726 |
US-2008194561-A1 | Compounds | 20050726 |
Complexity: | 282 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.08004122 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.08004122 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 78.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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