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1353970-89-4 | 2-Chloro-1-(3-methoxy-piperidin-1-yl)-ethanone
CAS No: 1353970-89-4 Catalog No: AG01FA2E MDL No:
Product Description
Catalog Number:
AG01FA2E
Chemical Name:
2-Chloro-1-(3-methoxy-piperidin-1-yl)-ethanone
CAS Number:
1353970-89-4
Molecular Formula:
C8H14ClNO2
Molecular Weight:
191.6553
IUPAC Name:
2-chloro-1-(3-methoxypiperidin-1-yl)ethanone
InChI:
InChI=1S/C8H14ClNO2/c1-12-7-3-2-4-10(6-7)8(11)5-9/h7H,2-6H2,1H3
InChI Key:
JYUZRAHRJRKTSH-UHFFFAOYSA-N
SMILES:
COC1CCCN(C1)C(=O)CCl
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.071g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.655g/mol
Monoisotopic Mass:
191.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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