1-(4-Chloro-2-fluorophenyl)-4-(2-nitrophenyl)piperazine - CAS 2006276-87-3
Catalog: |
BB015490 |
Product Name: |
1-(4-Chloro-2-fluorophenyl)-4-(2-nitrophenyl)piperazine |
CAS: |
2006276-87-3 |
Synonyms: |
1-(4-chloro-2-fluorophenyl)-4-(2-nitrophenyl)piperazine; 1-(4-chloro-2-fluorophenyl)-4-(2-nitrophenyl)piperazine |
IUPAC Name: | 1-(4-chloro-2-fluorophenyl)-4-(2-nitrophenyl)piperazine |
Description: | 1-(4-Chloro-2-fluorophenyl)-4-(2-nitrophenyl)piperazine (CAS# 2006276-87-3 ) is a useful research chemical. |
Molecular Weight: | 335.76 |
Molecular Formula: | C16H15ClFN3O2 |
Canonical SMILES: | C1CN(CCN1C2=C(C=C(C=C2)Cl)F)C3=CC=CC=C3[N+](=O)[O-] |
InChI: | InChI=1S/C16H15ClFN3O2/c17-12-5-6-14(13(18)11-12)19-7-9-20(10-8-19)15-3-1-2-4-16(15)21(22)23/h1-6,11H,7-10H2 |
InChI Key: | NDAPDTUMWLXZJR-UHFFFAOYSA-N |
Complexity: | 415 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 335.0836826 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 335.0836826 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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