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Home > Nitro Compounds > 27673-52-5
27673-52-5 | Piperazine, 4-nitroso-2-phenyl-1-(phenylmethyl)-, hydrochloride (1:1)
CAS No: 27673-52-5 Catalog No: AG002UES MDL No:
Product Description
Catalog Number:
AG002UES
Chemical Name:
Piperazine, 4-nitroso-2-phenyl-1-(phenylmethyl)-, hydrochloride (1:1)
CAS Number:
27673-52-5
Molecular Formula:
C17H20ClN3O
Molecular Weight:
317.8132
IUPAC Name:
1-benzyl-4-nitroso-2-phenylpiperazine;hydrochloride
InChI:
InChI=1S/C17H19N3O.ClH/c21-18-20-12-11-19(13-15-7-3-1-4-8-15)17(14-20)16-9-5-2-6-10-16;/h1-10,17H,11-14H2;1H
InChI Key:
JHSCYYIUBVGWMP-UHFFFAOYSA-N
SMILES:
O=NN1CCN(C(C1)c1ccccc1)Cc1ccccc1.Cl
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.129g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.817g/mol
Monoisotopic Mass:
317.129g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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