Home Carbonyls 1-(piperidine-4-carbonyl)azepane hydrochloride

1-(piperidine-4-carbonyl)azepane hydrochloride

CAS No.:
1049723-07-0
Catalog Number:
AG019OKK
Molecular Formula:
C12H23ClN2O
Molecular Weight:
246.7768
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Product Description
Catalog Number:
AG019OKK
Chemical Name:
1-(piperidine-4-carbonyl)azepane hydrochloride
CAS Number:
1049723-07-0
Molecular Formula:
C12H23ClN2O
Molecular Weight:
246.7768
MDL Number:
MFCD08445290
IUPAC Name:
azepan-1-yl(piperidin-4-yl)methanone;hydrochloride
InChI:
InChI=1S/C12H22N2O.ClH/c15-12(11-5-7-13-8-6-11)14-9-3-1-2-4-10-14;/h11,13H,1-10H2;1H
InChI Key:
NQSVSTDUXRGTLX-UHFFFAOYSA-N
SMILES:
O=C(N1CCCCCC1)C1CCNCC1.Cl
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.15g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
246.779g/mol
Monoisotopic Mass:
246.15g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties