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1260759-31-6 | Ethanone, 1-[4-(2-chloroethyl)-1-piperidinyl]-
CAS No: 1260759-31-6 Catalog No: AG000R4L MDL No:
Product Description
Catalog Number:
AG000R4L
Chemical Name:
Ethanone, 1-[4-(2-chloroethyl)-1-piperidinyl]-
CAS Number:
1260759-31-6
Molecular Formula:
C9H16ClNO
Molecular Weight:
189.6824
IUPAC Name:
1-[4-(2-chloroethyl)piperidin-1-yl]ethanone
InChI:
InChI=1S/C9H16ClNO/c1-8(12)11-6-3-9(2-5-10)4-7-11/h9H,2-7H2,1H3
InChI Key:
WVESLTAEPFAGOX-UHFFFAOYSA-N
SMILES:
ClCCC1CCN(CC1)C(=O)C
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.092g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.683g/mol
Monoisotopic Mass:
189.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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