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20386-34-9 | Methanone, [4-(2-chlorophenyl)-1-piperazinyl]phenyl-
CAS No: 20386-34-9 Catalog No: AG002961 MDL No:
Product Description
Catalog Number:
AG002961
Chemical Name:
Methanone, [4-(2-chlorophenyl)-1-piperazinyl]phenyl-
CAS Number:
20386-34-9
Molecular Formula:
C17H17ClN2O
Molecular Weight:
300.7827
IUPAC Name:
[4-(2-chlorophenyl)piperazin-1-yl]-phenylmethanone
InChI:
InChI=1S/C17H17ClN2O/c18-15-8-4-5-9-16(15)19-10-12-20(13-11-19)17(21)14-6-2-1-3-7-14/h1-9H,10-13H2
InChI Key:
QJMKZHNAVLJIBG-UHFFFAOYSA-N
SMILES:
Clc1ccccc1N1CCN(CC1)C(=O)c1ccccc1
NSC Number:
89451
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.103g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.786g/mol
Monoisotopic Mass:
300.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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