1-(2,4-Dinitrophenyl)-piperazine hydrochloride - CAS 125422-00-6
Catalog: |
BB067247 |
Product Name: |
1-(2,4-Dinitrophenyl)-piperazine hydrochloride |
CAS: |
125422-00-6 |
Synonyms: |
1-(2,4-Dinitrophenyl)-piperazine HCl; 1-(2,4-dinitrophenyl)piperazine; hydrochloride; 1-(2,4-DINITROPHENYL)PIPERAZINE HYDROCHLORIDE |
IUPAC Name: | 1-(2,4-dinitrophenyl)piperazinehydrochloride |
Description: | 1-(2,4-Dinitrophenyl)-piperazine hcl |
Molecular Weight: | 288.69 |
Molecular Formula: | C10H13ClN4O4 |
Canonical SMILES: | C1CN(CCN1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].Cl |
InChI: | InChI=1S/C10H12N4O4.ClH/c15-13(16)8-1-2-9(10(7-8)14(17)18)12-5-3-11-4-6-12/h1-2,7,11H,3-6H21H |
InChI Key: | DFQXUMGVTODBFH-UHFFFAOYSA-N |
Complexity: | 321 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 288.0625326 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 288.0625326 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 107Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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