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144068-31-5 | Ethanone, 1-(4-chlorophenyl)-2-[1-(cyclopropylmethyl)-4-piperidinyl]-
CAS No: 144068-31-5 Catalog No: AG001IV7 MDL No:
Product Description
Catalog Number:
AG001IV7
Chemical Name:
Ethanone, 1-(4-chlorophenyl)-2-[1-(cyclopropylmethyl)-4-piperidinyl]-
CAS Number:
144068-31-5
Molecular Formula:
C17H22ClNO
Molecular Weight:
291.8157
IUPAC Name:
1-(4-chlorophenyl)-2-[1-(cyclopropylmethyl)piperidin-4-yl]ethanone
InChI:
InChI=1S/C17H22ClNO/c18-16-5-3-15(4-6-16)17(20)11-13-7-9-19(10-8-13)12-14-1-2-14/h3-6,13-14H,1-2,7-12H2
InChI Key:
LJRYGMQGFOOAQO-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)CC1CCN(CC1)CC1CC1
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.139g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.819g/mol
Monoisotopic Mass:
291.139g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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