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67199-20-6 | 1-Piperazinecarboxaldehyde, 4-(diphenylacetyl)-
CAS No: 67199-20-6 Catalog No: AG0063SO MDL No:
Product Description
Catalog Number:
AG0063SO
Chemical Name:
1-Piperazinecarboxaldehyde, 4-(diphenylacetyl)-
CAS Number:
67199-20-6
Molecular Formula:
C19H20N2O2
Molecular Weight:
308.3743
IUPAC Name:
4-(2,2-diphenylacetyl)piperazine-1-carbaldehyde
InChI:
InChI=1S/C19H20N2O2/c22-15-20-11-13-21(14-12-20)19(23)18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2
InChI Key:
RNTQHIQZNFUNQA-UHFFFAOYSA-N
SMILES:
O=CN1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.152g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.381g/mol
Monoisotopic Mass:
308.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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