Home Other Building Blocks 2-(3,5-dimethylphenoxy)-1-(piperazin-1-yl)ethan-1-one hydrochloride

2-(3,5-dimethylphenoxy)-1-(piperazin-1-yl)ethan-1-one hydrochloride

CAS No.:
1423033-22-0
Catalog Number:
AG01A1EP
Molecular Formula:
C14H21ClN2O2
Molecular Weight:
284.7817
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Product Description
Catalog Number:
AG01A1EP
Chemical Name:
2-(3,5-dimethylphenoxy)-1-(piperazin-1-yl)ethan-1-one hydrochloride
CAS Number:
1423033-22-0
Molecular Formula:
C14H21ClN2O2
Molecular Weight:
284.7817
MDL Number:
MFCD22421816
IUPAC Name:
2-(3,5-dimethylphenoxy)-1-piperazin-1-ylethanone;hydrochloride
InChI:
InChI=1S/C14H20N2O2.ClH/c1-11-7-12(2)9-13(8-11)18-10-14(17)16-5-3-15-4-6-16;/h7-9,15H,3-6,10H2,1-2H3;1H
InChI Key:
NLKRSGKFEBNZKG-UHFFFAOYSA-N
SMILES:
O=C(N1CCNCC1)COc1cc(C)cc(c1)C.Cl
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.129g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.784g/mol
Monoisotopic Mass:
284.129g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties