Home Halogens 4-chloro-1-(piperidin-1-yl)butan-1-one

4-chloro-1-(piperidin-1-yl)butan-1-one

CAS No.:
90436-20-7
Catalog Number:
AG01B1E3
Molecular Formula:
C9H16ClNO
Molecular Weight:
189.6824
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Product Description
Catalog Number:
AG01B1E3
Chemical Name:
4-chloro-1-(piperidin-1-yl)butan-1-one
CAS Number:
90436-20-7
Molecular Formula:
C9H16ClNO
Molecular Weight:
189.6824
MDL Number:
MFCD01159124
IUPAC Name:
4-chloro-1-piperidin-1-ylbutan-1-one
InChI:
InChI=1S/C9H16ClNO/c10-6-4-5-9(12)11-7-2-1-3-8-11/h1-8H2
InChI Key:
NLURCGOBHUYBNK-UHFFFAOYSA-N
SMILES:
ClCCCC(=O)N1CCCCC1
NSC Number:
195008
Properties
Complexity:
144  
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:
3  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties